Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1811642

Cc1cncc2cccc(S(=O)(=O)N3CCCN(C(=O)CN)CC3C)c12.Cl.Cl

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 known ✓ O75116 12/20 0.74
ROCK1 known ✓ Q13464 12/20 0.74
PRKCD known ✓ Q05655 4/20 0.59
PRKD3 known ✓ O94806 3/20 0.59
PRKCZ known ✓ Q05513 3/20 0.59
LCK known ✓ P06239 1/20 0.59
FGFR1 known ✓ P11362 1/20 0.59
FLT4 known ✓ P35916 1/20 0.59
KDR known ✓ P35968 1/20 0.59
MMP1 known ✓ P03956 2/20 0.41
MMP13 known ✓ P45452 2/20 0.41
PRKCG known ✓ P05129 2/20 0.39
PRKCB known ✓ P05771 2/20 0.39
PRKCA known ✓ P17252 2/20 0.39
PRKCH known ✓ P24723 2/20 0.39
PRKCI known ✓ P41743 2/20 0.39
PRKCE known ✓ Q02156 2/20 0.39
PRKCQ known ✓ Q04759 2/20 0.39
PRKD1 known ✓ Q15139 2/20 0.39
PRKACA P17612 4/20 0.59

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL1811640 1.00 ROCK2 (0.74) ROCK2ROCK1PRKACAPRKCDPRKD3
SCHEMBL678400 0.99 ROCK2 (0.75) ROCK2ROCK1PRKACAPRKCDPRKD3
SCHEMBL30168969 0.99 ROCK2 (0.75) ROCK2ROCK1PRKACAPRKCDPRKD3
SCHEMBL4553608 0.99 ROCK2 (0.75) ROCK2ROCK1PRKACAPRKCDPRKD3
Hydrochloric Acid SCHEMBL4897166 0.91 ROCK2 (0.66) ROCK2ROCK1PRKACAPRKCDPRKD3
Hydrochloric Acid SCHEMBL4897175 0.91 ROCK2 (0.66) ROCK2ROCK1PRKACAPRKCDPRKD3
SCHEMBL13951383 0.90 ROCK2 (0.62) ROCK2ROCK1PRKACAPRKCDPRKD3
SCHEMBL13606963 0.90 ROCK2 (0.62) ROCK2ROCK1PRKACAPRKCDPRKD3
SCHEMBL13606925 0.90 ROCK2 (0.67) ROCK2ROCK1PRKACAPRKCDPRKD3
SCHEMBL13606964 0.88 ROCK2 (0.60) ROCK2ROCK1PRKACAPRKCDPRKD3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12618830-B2 Methods, culture medias and devices for generating embryos in vitro from stem cells CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2026-05-05 US disclosed
US-20260062678-A1 CELL REPLACEMENT THERAPY FOR PULMONARY DISEASES THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2026-03-05 US disclosed
US-12467917-B2 Reconstructing human early embryogenesis in vitro with pluripotent stem cells CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2025-11-11 US disclosed
US-12123023-B2 Methods for generating stem cell-derived β cells and methods of use thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2024-10-22 US disclosed
US-20240158753-A1 SERUM-FREE IN VITRO DIRECTED DIFFERENTIATION PROTOCOL FOR GENERATING STEM CELL-DERIVED BETA CELLS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2024-05-16 US disclosed
US-20240124835-A1 METHODS AND DEVICES FOR GENERATING EMBRYOS IN VITRO FROM EMBRYONIC STEM CELLS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-04-18 US disclosed
US-20240101957-A1 METHODS AND COMPOSITIONS FOR GENERATING EMBRYOS IN VITRO FROM PLURIPOTENT STEM CELLS CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-03-28 US disclosed
US-20240093144-A1 DIFFERENTIAL ADHESION AND TENSION GUIDED FORMATION OF STEM CELL DERIVED EMBRYOS CALIFORNIA INSTITUTE OF TECHNOLOGY 2024-03-21 US disclosed
WO-2024050546-A1 METHODS AND CULTURE MEDIA FOR GENERATING EMBRYOS IN VITRO FROM PLURIPOTENT STEM CELLS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2024-03-07 WO disclosed
US-11739299-B2 Lung and airway progenitors generated from human pluripotent stem cells and related treatments THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-08-29 US disclosed
WO-2019217429-A1 LUNG AND AIRWAY PROGENITORS GENERATED FROM HUMAN PLURIPOTENT STEM CELLS AND RELATED TREATMENTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-11-14 WO disclosed
US-20190338250-A1 METHODS FOR GENERATING STEM CELL-DERIVED BETA CELLS AND METHODS OF USE THEREOF HOWARD HUGHES MEDICAL INSTITUTE 2019-11-07 US disclosed
US-10443042-B2 Serum-free in vitro directed differentiation protocol for generating stem cell-derived beta cells and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-10-15 US disclosed
US-10253298-B2 Methods for generating stem cell-derived beta cells and methods of use thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-04-09 US disclosed
US-9969972-B2 Pluripotent stem cell culture on micro-carriers JANSSEN BIOTECH, INC. (US) 2018-05-15 US disclosed
US-20160177269-A1 METHODS FOR GENERATING STEM CELL-DERIVED BETA CELLS AND METHODS OF USE THEREOF HOWARD HUGHES MEDICAL INSTITUTE 2016-06-23 US disclosed
US-20160177267-A1 SERUM-FREE IN VITRO DIRECTED DIFFERENTIATION PROTOCOL FOR GENERATING STEM CELL-DERIVED BETA CELLS AND USES THEREOF HOWARD HUGHES MEDICAL INSTITUTE 2016-06-23 US disclosed
US-20150166950-A1 Pluripotent Stem Cell Culture on Micro-Carriers JANSSEN BIOTECH, INC. (US) 2015-06-18 US disclosed
US-20110104805-A1 Pluripotent Stem Cells CENTOCOR ORTHO BIOTECH INC. (US) 2011-05-05 US disclosed
US-20100124781-A1 Pluripotent Stem Cell Culture on Micro-Carriers NELSON SHELLEY 2010-05-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10253298-B2 Methods for generating stem cell-derived beta cells and methods of use thereof IAPP, RNASE1, PNLIP ROCK2 2425/4885ROCK1 2444/4885PRKCD 532/4885
US-12123023-B2 Methods for generating stem cell-derived β cells and methods of use thereof IAPP, RNASE1, PNLIP ROCK2 2126/4885ROCK1 2141/4885PRKCD 548/4885
US-20260062678-A1 CELL REPLACEMENT THERAPY FOR PULMONARY DISEASES WNT3A, BMP4, GSK3B ROCK2 14/4885ROCK1 12/4885PRKCD 68/4885
US-12618830-B2 Methods, culture medias and devices for generating embryos in vitro from stem cells POU2F1, POU5F1, POU2F2 ROCK2 2165/4885ROCK1 2793/4885PRKCD 677/4885
US-20160177269-A1 METHODS FOR GENERATING STEM CELL-DERIVED BETA CELLS AND METHODS OF USE THEREOF IAPP, RNASE1, PNLIP ROCK2 2425/4885ROCK1 2444/4885PRKCD 532/4885
US-20190338250-A1 METHODS FOR GENERATING STEM CELL-DERIVED BETA CELLS AND METHODS OF USE THEREOF IAPP, RNASE1, PNLIP ROCK2 2425/4885ROCK1 2444/4885PRKCD 532/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.