Hydrochloric Acid

Hydrochloric Acid

SCHEMBL197143

[Cl-].[Cl-].[Ni+2].c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.45

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 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
ESR1 P03372 4/20 0.35
ESR2 Q92731 4/20 0.35
CALM1 P0DP23 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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 SCHEMBL10689263 1.00 CYP3A4 (0.45) CYP3A4TDP1KDM4EGAAESR1
Hydrochloric Acid SCHEMBL9806651 0.97 TDP1 (0.47) CYP3A4TDP1KDM4EGAAESR1
SCHEMBL31242726 0.97 CYP3A4 (0.47) CYP3A4TDP1KDM4EGAAESR1
Hydrochloric Acid SCHEMBL9815434 0.97 TDP1 (0.47) CYP3A4TDP1KDM4EGAAESR1
Hydrochloric Acid SCHEMBL11017606 0.94 CYP3A4 (0.45) CYP3A4TDP1KDM4EGAAESR1
Hydrochloric Acid SCHEMBL10603455 0.94 CYP3A4 (0.45) CYP3A4TDP1KDM4EGAAESR1
Hydrochloric Acid SCHEMBL1450045 0.94 CYP3A4 (0.45) CYP3A4TDP1KDM4EGAAESR1
Hydrochloric Acid SCHEMBL17008412 0.94 CYP3A4 (0.45) CYP3A4TDP1KDM4EGAAESR1
Hydrochloric Acid SCHEMBL19460486 0.94 CYP3A4 (0.45) CYP3A4TDP1KDM4EGAAESR1
Hydrochloric Acid SCHEMBL9803750 0.94 CYP3A4 (0.45) CYP3A4TDP1KDM4EGAAESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022252789-A1 METHOD FOR PREPARING JAK INHIBITOR KEY INTERMEDIATE 山东莱福科技发展有限公司 2022-12-08 WO claimed
EP-3275881-B1 COMPOUND OF 5-HYDROXYL-1,7-NAPHTHYRIDINE SUBSTITUTED BY ARYLOXY OR HETEROOXY, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE THEREOF SHENYANG SUNSHINE PHARMACEUTICAL CO LTD (CN) 2021-08-04 EP claimed
US-10100051-B2 Compound of 5-hydroxyl-1,7-naphthyridine substituted by aryloxy or heteroaryloxy, preparation method thereof and pharmaceutical use thereof SHENYANG SUNSHINE PHARMACEUTICAL CO. LTD. (CN) 2018-10-16 US claimed
US-20180118739-A1 COMPOUND OF 5-HYDROXYL-1,7-NAPHTHYRIDINE SUBSTITUTED BY ARYLOXY OR HETEROARYLOXY, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE THEREOF SHENYANG SUNSHINE PHARMACEUTICAL CO., LTD. (CN) 2018-05-03 US claimed
EP-3275881-A1 COMPOUND OF 5-HYDROXYL-1,7-NAPHTHYRIDINE SUBSTITUTED BY ARYLOXY OR HETEROOXY, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE THEREOF Shenyang Sunshine Pharmaceutical Co., Ltd. (CN) 2018-01-31 EP claimed
US-9708432-B2 Highly sensitive (meth)acrylate and radical curable material AUTONETWORKS TECHNOLOGIES, LTD. (JP) 2017-07-18 US claimed
US-9611337-B2 Chain transfer agent, photosensitive composition, cured product of photosensitive composition, and method for curing photosensitive composition AUTONETWORKS TECHNOLOGIES, LTD. (JP) 2017-04-04 US claimed
EP-2083033-B1 Organic semiconducting copolymer and organic electronic device including the same SAMSUNG ELECTRONICS CO LTD (KR) 2012-04-18 EP claimed
EP-1846472-B1 PROCESS OF PREPARING REGIOREGULAR POLYMERS MERCK PATENT GMBH (DE) 2011-03-23 EP claimed
US-7807776-B2 Procees of preparing regioregular polymers MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-10-05 US claimed
US-20050080219-A1 Process of preparing regioregular polymers MERCK PATENT GMBH (DE) 2005-04-14 US claimed
US-20040030091-A1 Lightweight, electroconductivity, heat resistance MCCULLOUGH RICHARD D (US) 2004-02-12 US claimed
US-20040024171-A1 Stereospecific electroconductive polymers such as polyhexylthiophene-polystyrene or -polymethylacrylate copolymers, used as light emitting diodes, biosensors, transistors, displays or optical apparatus MCCULLOUGH RICHARD D (US) 2004-02-05 US claimed
US-6602974-B1 Conducting polymers, head-to-tail coupled regioregular polythiophenes, poly-(3-substituted) thiophene diol CARNEGIE MELLON UNIVERSITY 2003-08-05 US claimed
EP-0973784-B1 PREPARATION OF TERTIARY PHOSPHINES VIA NICKEL-CATALYZED CROSS COUPLING PCBU SERVICES INC (US) 2002-01-16 EP claimed
US-6166172-A Method of forming poly-(3-substituted) thiophenes CARNEGIE MELLON UNIVERSITY (US) 2000-12-26 US claimed
EP-1028136-A2 A method of forming poly-(3-substituted) thiophenes CARNEGIE-MELLON UNIVERSITY (US) 2000-08-16 EP claimed
US-5874628-A Method for preparation of tertiary phosphines via nickel-catalyzed cross coupling MONSANTO COMPANY (US) 1999-02-23 US claimed
EP-0532515-B1 PREPARATION OF SUBSTITUTED PIPERIDINES PFIZER (US) 1996-10-23 EP claimed
EP-0619806-B1 PREPARATION OF SUBSTITUTED PIPERIDINES PFIZER (US) 1996-01-03 EP claimed

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-20180118739-A1 COMPOUND OF 5-HYDROXYL-1,7-NAPHTHYRIDINE SUBSTITUTED BY ARYLOXY OR HETEROARYLOXY, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE THEREOF HIF1AN, EGLN3, EGLN2 CYP3A4 82/4885TDP1 4547/4885KDM4E 673/4885
US-10100051-B2 Compound of 5-hydroxyl-1,7-naphthyridine substituted by aryloxy or heteroaryloxy, preparation method thereof and pharmaceutical use thereof HIF1AN, EGLN3, EGLN2 CYP3A4 82/4885TDP1 4547/4885KDM4E 673/4885

“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.