Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1375746

CN[C@H]1CN(Cc2ccccc2)CC[C@H]1C.Cl.Cl

nearest known ligand 0.55

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 12)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 9/20 0.55
BCHE known ✓ P06276 9/20 0.51
SCN4A known ✓ P35499 2/20 0.47
SIGMAR1 known ✓ Q99720 2/20 0.45
BACE1 P56817 8/20 0.51
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
CCR3 P51677 1/20 0.46
CXCR4 P61073 1/20 0.44

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 SCHEMBL20597421 1.00 ACHE (0.55) ACHEBCHEBACE1ALDH1A1SCN4A
Hydrochloric Acid SCHEMBL1373413 1.00 ACHE (0.55) ACHEBCHEBACE1ALDH1A1SCN4A
Hydrochloric Acid SCHEMBL22500017 1.00 ACHE (0.55) ACHEBCHEBACE1ALDH1A1SCN4A
Hydrochloric Acid SCHEMBL29414409 1.00 ACHE (0.55) ACHEBCHEBACE1ALDH1A1SCN4A
Hydrochloric Acid SCHEMBL1847744 1.00 ACHE (0.55) ACHEBCHEBACE1ALDH1A1SCN4A
Hydrochloric Acid SCHEMBL1373407 1.00 ACHE (0.55) ACHEBCHEBACE1ALDH1A1SCN4A
Hydrochloric Acid SCHEMBL2148084 1.00 ACHE (0.55) ACHEBCHEBACE1ALDH1A1SCN4A
SCHEMBL1993388 0.98 ACHE (0.57) ACHEBCHEBACE1ALDH1A1SCN4A
SCHEMBL14018259 0.98 ACHE (0.57) ACHEBCHEBACE1ALDH1A1SCN4A
SCHEMBL352022 0.98 ACHE (0.57) ACHEBCHEBACE1ALDH1A1SCN4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119574716-A Method for detecting impurities in (3R, 4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine dihydrochloride 南京药石科技股份有限公司 2025-03-07 CN claimed
CN-113930404-B Method for synthesizing chiral tofacitinib citrate intermediate by enzymatic method 浙江乐普药业股份有限公司 2023-10-13 CN claimed
CN-115808472-A Method for analyzing and detecting impurity BMPA-3 in R-BMPA 江苏万邦生化医药集团有限责任公司 2023-03-17 CN claimed
CN-112213402-B Method for detecting (3R, 4R) -1-benzyl-N, 4-dimethylpiperidine-3-amine dihydrochloride and isomer thereof 江苏晶立信医药科技有限公司 2022-11-04 CN claimed
CN-111574522-B Synthesis method of tofacitinib key intermediate 杭州华东医药集团浙江华义制药有限公司 2021-11-23 CN claimed
CN-111574522-A Synthesis method of tofacitinib key intermediate 杭州华东医药集团浙江华义制药有限公司 2020-08-25 CN claimed
CN-121378106-A Tofacitinib citrate preparation method of intermediate 江苏威奇达药业有限公司 2026-01-23 CN disclosed
CN-121164475-A Analytical method for determining enantiomer and diastereoisomer of (3R, 4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine dihydrochloride 江苏艾立康医药科技有限公司 2025-12-19 CN disclosed
CN-121164475-A Analytical method for determining enantiomer and diastereoisomer of (3R, 4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine dihydrochloride 江苏艾立康医药科技有限公司 2025-12-19 CN disclosed
EP-4656249-A2 PYRAZOLOPYRIMIDINE DERIVATIVES AS KINASE INHIBITOR Daewoong Pharmaceutical Co., Ltd. (KR) 2025-12-03 EP disclosed
CN-119574716-A Method for detecting impurities in (3R, 4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine dihydrochloride 南京药石科技股份有限公司 2025-03-07 CN disclosed
CN-119574716-A Method for detecting impurities in (3R, 4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine dihydrochloride 南京药石科技股份有限公司 2025-03-07 CN disclosed
CN-119574716-A Method for detecting impurities in (3R, 4R) -1-benzyl-N, 4-dimethylpiperidin-3-amine dihydrochloride 南京药石科技股份有限公司 2025-03-07 CN disclosed
EP-3327021-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF Yangji Chemical Co., Ltd. (KR) 2018-05-30 EP disclosed
CN-107064350-A Method for detecting suspected genotoxic impurity of tofacitinib citrate 山东裕欣药业有限公司 2017-08-18 CN disclosed
EP-1913000-B1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES; THEIR INTERMEDIATES AND SYNTHESIS PFIZER PROD INC (US) 2012-01-11 EP disclosed
US-20110288297-A1 Pyrrolo[2,3-d]Pyrimidine Derivatives; Their Intermediates and Synthesis PFIZER, INC. (US) 2011-11-24 US disclosed
US-20110165183-A1 PIPERIDINE DERIVATIVES AS JAK3 INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2011-07-07 US disclosed
EP-2324020-A2 PIPERIDINE DERIVATIVES AS JAK3 INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2011-05-25 EP disclosed
WO-2010014930-A2 THERAPEUTIC AGENTS BIOCRYST PHARMACEUTICALS, INC. (US) 2010-02-04 WO 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 (2 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-20110165183-A1 PIPERIDINE DERIVATIVES AS JAK3 INHIBITORS JAK3, JAK2, JAK1 ACHE 4871/4885BCHE 4767/4885SCN4A 2205/4885
US-20110288297-A1 Pyrrolo[2,3-d]Pyrimidine Derivatives; Their Intermediates and Synthesis DPYD, CPS1, TYMS ACHE 4478/4885BCHE 4680/4885SCN4A 2695/4885

“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.