Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3848626

Cc1n(C)cc[n+]1CC(=O)c1ccc(Cl)cc1Cl.[Cl-]

nearest known ligand 0.52

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 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.49
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 1/20 0.47
HIF1A Q16665 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
HSD17B10 Q99714 1/20 0.45
ERCC5 P28715 1/20 0.43
FEN1 P39748 1/20 0.43
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
USP2 O75604 1/20 0.40
ALOX15 P16050 1/20 0.40
CYP2C9 P11712 1/20 0.40
TSHR P16473 1/20 0.40
CASP1 P29466 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
P2RX7 Q99572 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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 SCHEMBL3846470 0.79 POLB (0.57) POLBALDH1A1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL3851951 0.78 CES2 (0.41) ALDH1A1MAPTNPC1RAB9AHTT
Bromide SCHEMBL3849526 0.76 FEN1 (0.40) POLBALDH1A1MAPK1SMN1; SMN2FEN1
Hydrochloric Acid SCHEMBL5975641 0.75 ALDH1A1 (0.48) POLBALDH1A1MAPK1HIF1ASMN1; SMN2
Hydrochloric Acid SCHEMBL3847701 0.75 ALDH1A1 (0.48) POLBALDH1A1MAPK1HIF1ASMN1; SMN2
Hydrochloric Acid SCHEMBL3848623 0.73 POLB (0.53) POLBALDH1A1MAPK1HIF1ASMN1; SMN2
Hydrochloric Acid SCHEMBL3851286 0.73 KMT2A (0.50) POLBALDH1A1MAPK1HIF1ASMN1; SMN2
Bromide SCHEMBL3853760 0.70 KMT2A (0.46) ALDH1A1MAPK1SMN1; SMN2KMT2AUSP2
Bromide SCHEMBL3850367 0.70 CES2 (0.39) POLBALDH1A1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL3847700 0.69 SMN1; SMN2 (0.52) POLBALDH1A1MAPK1HIF1ASMN1; SMN2

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-1517879-A4 AMINOALKYLPHENOLS, METHODS OF USING AND MAKING THE SAME MERCK & CO INC (US) 2006-09-13 EP claimed
EP-1517879-A1 AMINOALKYLPHENOLS, METHODS OF USING AND MAKING THE SAME Merck & Co., Inc. (US) 2005-03-30 EP claimed
WO-2004000783-A1 AMINOALKYLPHENOLS, METHODS OF USING AND MAKING THE SAME MERCK & CO., INC. (US) 2003-12-31 WO claimed
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
US-20040235837-A1 Method for treating fibrotic diseases or other indications IE SYNVISTA THERAPEUTICS, INC. 2004-11-25 US 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
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 POLB 2072/4885ALDH1A1 175/4885MAPK1 3400/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 POLB 3857/4885ALDH1A1 366/4885MAPK1 3561/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 POLB 2130/4885ALDH1A1 204/4885MAPK1 4033/4885
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, COL2A1 POLB 3175/4885ALDH1A1 192/4885MAPK1 3335/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 POLB 3981/4885ALDH1A1 402/4885MAPK1 3518/4885
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID MMP1, COL1A1, COL2A1 POLB 1901/4885ALDH1A1 261/4885MAPK1 3734/4885
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, EPX POLB 3600/4885ALDH1A1 431/4885MAPK1 3967/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 POLB 4353/4885ALDH1A1 448/4885MAPK1 4032/4885

“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.