Hydrochloric Acid

Hydrochloric Acid

SCHEMBL68511

CCCCCCCCCCCCCCCCCC(=O)NCCCCN(C)C.Cl

nearest known ligand 0.87

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 8)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.87
CASP2 P42575 1/20 0.62
FAAH O00519 5/20 0.60
NAAA Q02083 1/20 0.59
SLC6A5 Q9Y345 2/20 0.56
EPHX2 P34913 3/20 0.55
THRA P10827 1/20 0.50
THRB P10828 1/20 0.50

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
SCHEMBL9549112 0.98 DNM1 (0.90) DNM1CASP2FAAHNAAASLC6A5
SCHEMBL1601857 0.98 DNM1 (0.90) DNM1CASP2FAAHNAAASLC6A5
SCHEMBL27964228 0.98 DNM1 (0.90) DNM1CASP2FAAHNAAASLC6A5
SCHEMBL1603004 0.98 DNM1 (0.90) DNM1CASP2FAAHNAAASLC6A5
SCHEMBL9665089 0.98 DNM1 (0.90) DNM1CASP2FAAHNAAASLC6A5
SCHEMBL18632644 0.98 DNM1 (0.90) DNM1CASP2FAAHNAAASLC6A5
SCHEMBL19479185 0.98 DNM1 (0.90) DNM1CASP2FAAHNAAASLC6A5
SCHEMBL22907872 0.95 DNM1 (0.84) DNM1CASP2FAAHNAAASLC6A5
SCHEMBL22907945 0.95 DNM1 (0.84) DNM1CASP2FAAHNAAASLC6A5
SCHEMBL21419343 0.95 DNM1 (0.84) DNM1CASP2FAAHNAAASLC6A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10781405-B2 Polyetheramine compositions for laundry detergents STEPAN COMPANY (US) 2020-09-22 US disclosed
EP-3458567-A1 POLYETHERAMINE COMPOSITIONS FOR LAUNDRY DETERGENTS Stepan Company (US) 2019-03-27 EP disclosed
US-20190085266-A1 POLYETHERAMINE COMPOSITIONS FOR LAUNDRY DETERGENTS STEPAN COMPANY 2019-03-21 US disclosed
EP-2475756-B1 LIQUID CLEANING COMPOSITIONS CONTAINING SULFONATED ESTOLIDES AND ALKYL ESTER SULFONATES STEPAN CO (US) 2019-01-16 EP disclosed
WO-2017200737-A1 POLYETHERAMINE COMPOSITIONS FOR LAUNDRY DETERGENTS STEPAN COMPANY (US) 2017-11-23 WO disclosed
EP-2382295-B1 CLEANER COMPOSITIONS OF SULFONATED ESTOLIDES AND USES THEREOF STEPAN CO (US) 2016-05-18 EP disclosed
EP-2277860-B1 Compositions comprising sulfonated estolides and alkyl ester sulfonates, methods of making them, and compositions and processes employing them STEPAN CO (US) 2015-08-19 EP disclosed
EP-2831139-A1 SURFACTANTS AND SOLVENTS CONTAINING DIELS-ALDER ADDUCTS Stepan Company (US) 2015-02-04 EP disclosed
EP-2247574-B1 SULFONATED ESTOLIDES AND OTHER DERIVATIVES OF FATTY ACIDS, METHODS OF MAKING THEM, AND COMPOSITIONS AND PROCESSES EMPLOYING THEM STEPAN CO (US) 2015-01-07 EP disclosed
EP-2270122-B1 Sulfonated estolides and other derivatives of fatty acids, methods of making them, and compositions and processes employing them STEPAN CO (US) 2015-01-07 EP disclosed
EP-2270122-A2 Sulfonated estolides and other derivatives of fatty acids, methods of making them, and compositions and processes employing them STEPAN COMPANY (US) 2011-01-05 EP disclosed
EP-2258679-A2 Sulfonated estolides and other derivatives of fatty acids, methods of making them, and compositions and processes employing them STEPAN COMPANY (US) 2010-12-08 EP disclosed
EP-2258817-A2 Sulfonated estolides and other derivatives of fatty acids, methods of making them, and compositions and processes employing them STEPAN COMPANY (US) 2010-12-08 EP disclosed
EP-2247574-A2 SULFONATED ESTOLIDES AND OTHER DERIVATIVES OF FATTY ACIDS, METHODS OF MAKING THEM, AND COMPOSITIONS AND PROCESSES EMPLOYING THEM STEPAN COMPANY (US) 2010-11-10 EP disclosed
WO-2010085247-A1 SULFONATED ESTOLIDES AND OTHER DERIVATIVES OF FATTY ACIDS AND USES THEREOF STEPAN COMPANY (US) 2010-07-29 WO disclosed
US-20100184855-A1 Hard Surface Cleaner Compositions of Sulfonated Estolides and Other Derivatives of Fatty Acids and Uses Thereof STEPAN COMPANY 2010-07-22 US disclosed
US-7666828-B2 Sulfonated estolides and other derivatives of fatty acids, methods of making them, and compositions and processes employing them STEPAN COMPANY (US) 2010-02-23 US disclosed
US-20100016198-A1 Compositions Comprising Sulfonated Estolides And Alkyl Ester Sulfonates, Methods Of Making Them, And Compositions And Processes Employing Them STEPAN COMPANY 2010-01-21 US disclosed
WO-2009094336-A2 SULFONATED ESTOLIDES AND OTHER DERIVATIVES OF FATTY ACIDS, METHODS OF MAKING THEM, AND COMPOSITIONS AND PROCESSES EMPLOYING THEM STEPAN COMPANY (US) 2009-07-30 WO disclosed
US-20090188055-A1 SULFONATED ESTOLIDES AND OTHER DERIVATIVES OF FATTY ACIDS, METHODS OF MAKING THEM, AND COMPOSITIONS AND PROCESSES EMPLOYING THEM STEPAN COMPANY (US) 2009-07-30 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 (3 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-20100184855-A1 Hard Surface Cleaner Compositions of Sulfonated Estolides and Other Derivatives of Fatty Acids and Uses Thereof STS, ELOVL6, ELOVL1 DNM1 1212/4885CASP2 3069/4885FAAH 159/4885
US-20090188055-A1 SULFONATED ESTOLIDES AND OTHER DERIVATIVES OF FATTY ACIDS, METHODS OF MAKING THEM, AND COMPOSITIONS AND PROCESSES EMPLOYING THEM STS, ABHD16A, HDHD5 DNM1 3242/4885CASP2 2552/4885FAAH 12/4885
US-20100016198-A1 Compositions Comprising Sulfonated Estolides And Alkyl Ester Sulfonates, Methods Of Making Them, And Compositions And Processes Employing Them STS, ABHD16A, DEGS1 DNM1 3750/4885CASP2 2630/4885FAAH 245/4885

“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.