Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3846892

C[c+]1n(C)ccn1CC(=O)NCCCN1CCCCC1C.[Cl-]

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.49
KDM4E B2RXH2 1/20 0.49
CYP2D6 P10635 2/20 0.48
CYP2C19 P33261 2/20 0.48
CYP3A4 P08684 1/20 0.48
THRB P10828 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
CXCR4 P61073 6/20 0.44
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.43

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 SCHEMBL3846889 0.74 HSD17B10 (0.51) HSD17B10KDM4ECYP2D6CYP2C19CYP3A4
SCHEMBL16511223 0.74 CXCR4 (0.62) HSD17B10KDM4ECYP2D6CYP2C19CYP3A4
SCHEMBL13888624 0.74 CYP2D6 (0.56) HSD17B10KDM4ECYP2D6CYP2C19CYP3A4
SCHEMBL9541617 0.72 OPRD1 (0.63) HSD17B10KDM4ECYP2D6CYP2C19CYP3A4
Hydrochloric Acid SCHEMBL3846890 0.71 HSD17B10 (0.49) HSD17B10KDM4ECYP2D6CYP2C19CYP3A4
Hydrochloric Acid SCHEMBL9543047 0.71 OPRD1 (0.62) HSD17B10KDM4ECYP2D6CYP2C19CYP3A4
SCHEMBL19658452 0.71 CYP2D6 (0.53) HSD17B10KDM4ECYP2D6CYP2C19CYP3A4
SCHEMBL17589308 0.70 CYP2D6 (0.52) HSD17B10KDM4ECYP2D6CYP2C19CYP3A4
Hydrochloric Acid SCHEMBL3849426 0.69 CYP3A4 (0.48) CYP2C19CYP3A4TSHRKMT2AALDH1A1
SCHEMBL8594690 0.69 CYP2D6 (0.54) HSD17B10KDM4ECYP2D6CYP2C19CYP3A4

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2085086-A2 Method for treating congestive heart failure or diabetic nephropathy Synvista Therapeutics, Inc. (US) 2009-08-05 EP disclosed
US-20090124673-A1 Method for treating diabetic nephropathy SYNVISTA THERAPEUTICS , INC. (US) 2009-05-14 US disclosed
US-20090124674-A1 Method for treating congestive heart failure SYNVISTA THERAPEUTICS, INC. (US) 2009-05-14 US disclosed
US-7432254-B2 Method for treating glaucoma IC SYNVISTA THERAPEUTICS, INC. (US) 2008-10-07 US disclosed
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents SYNVISTA THERAPEUTICS, INC. 2007-02-22 US disclosed
US-7166625-B2 Method for treating fibrotic diseases and other indications ALTEON, INC. (US) 2007-01-23 US disclosed
EP-1305024-A4 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC ALTEON INC (US) 2006-03-22 EP disclosed
EP-1353669-A4 METHOD FOR TREATING GLAUCOMA IB ALTEON INC (US) 2005-10-19 EP disclosed
US-20040235837-A1 Method for treating fibrotic diseases or other indications IE SYNVISTA THERAPEUTICS, INC. 2004-11-25 US disclosed
EP-1353669-A1 METHOD FOR TREATING GLAUCOMA IB Alteon, Inc. (US) 2003-10-22 EP disclosed
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents ALTEON, INC. 2003-09-18 US disclosed
EP-1305024-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC Alteon, Inc. (US) 2003-05-02 EP disclosed
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID SYNVISTA THERAPEUTICS, INC. 2002-11-28 US disclosed
US-20020160993-A1 Method for treating glaucoma IC SYNVISTA THERAPEUTICS, INC. 2002-10-31 US disclosed
WO-2002053158-A1 METHOD FOR TREATING GLAUCOMA IB ALTEON, INC. (US) 2002-07-11 WO disclosed
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC ALTEON, INC. 2002-06-06 US disclosed
WO-2002007725-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC ALTEON, INC. (US) 2002-01-31 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 (8 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-20040235837-A1 Method for treating fibrotic diseases or other indications IE MMP1, COL1A1, COL2A1 HSD17B10 598/4885KDM4E 3755/4885CYP2D6 2820/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 HSD17B10 1740/4885KDM4E 4361/4885CYP2D6 3748/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 HSD17B10 715/4885KDM4E 3863/4885CYP2D6 3576/4885
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, COL2A1 HSD17B10 2387/4885KDM4E 3256/4885CYP2D6 2278/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 HSD17B10 774/4885KDM4E 3627/4885CYP2D6 2848/4885
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID MMP1, COL1A1, COL2A1 HSD17B10 599/4885KDM4E 3355/4885CYP2D6 2426/4885
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, EPX HSD17B10 2703/4885KDM4E 2770/4885CYP2D6 2446/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 HSD17B10 680/4885KDM4E 4392/4885CYP2D6 1723/4885

“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.