SCHEMBL5674353

SCHEMBL5674353

CCOC(=O)[C@@H](CCc1ccccc1)OS(=O)(=O)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
ACE P12821 3/20 0.44
MAPT P10636 2/20 0.42
TAAR1 Q96RJ0 2/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
BLM P54132 1/20 0.40
MMP8 P22894 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PIN1 Q13526 1/20 0.38

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
SCHEMBL1858577 1.00 SMN1; SMN2 (0.46) SMN1; SMN2ACEMAPTTAAR1THRB
SCHEMBL9773201 1.00 SMN1; SMN2 (0.46) SMN1; SMN2ACEMAPTTAAR1THRB
SCHEMBL10957115 0.90 KMT2A (0.39) SMN1; SMN2ACEMAPTHTTHSD17B10
SCHEMBL7722450 0.89 SMN1; SMN2 (0.48) SMN1; SMN2ACEMAPTMMP8PPARG
SCHEMBL20676404 0.89 ACE (0.37) SMN1; SMN2ACEMAPTHTTHSD17B10
SCHEMBL7375987 0.88 BLM (0.41) BLMPPARGPPARAL3MBTL1
SCHEMBL5012826 0.88 BLM (0.41) BLMPPARGPPARAL3MBTL1
SCHEMBL8142297 0.88 MEN1 (0.43) SMN1; SMN2BLMPPARGPPARA
SCHEMBL7344531 0.88 BLM (0.41) BLMPPARGPPARAL3MBTL1
SCHEMBL7728941 0.88 MEN1 (0.43) SMN1; SMN2BLMPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005122682-A2 PROCESS FOR THE PREPARATION OF ESTERS OF PIPERAZIC ACID RANBAXY LABORATORIES LIMITED (IN) 2005-12-29 WO claimed
EP-3543225-B1 METHOD FOR PREPARING LISINOPRIL INTERMEDIATE ZHEJIANG HUAHAI PHARM CO LTD (CN) 2023-01-04 EP disclosed
CN-109438449-B Synthesis method of cilazapril containing hexahydropyridazine acid structure 厦门医学院 2020-08-11 CN disclosed
US-20200231554-A1 LIPOPHILIC MACROCYCLIC LIGANDS, COMPLEXES THEREOF, AND USES OF SAME GUERBET (FR) 2020-07-23 US disclosed
WO-2019016377-A1 LIPOPHILIC MACROCYCLIC LIGANDS, COMPLEXES THEREOF, AND USES OF SAME GUERBET (FR) 2019-01-24 WO disclosed
EP-1383741-A4 PROCESS FOR THE PREPARATION OF BENAZEPRIL RANBAXY LAB LTD (IN) 2006-01-04 EP disclosed
WO-2005122682-A2 PROCESS FOR THE PREPARATION OF ESTERS OF PIPERAZIC ACID RANBAXY LABORATORIES LIMITED (IN) 2005-12-29 WO disclosed
US-6919450-B2 Process for the preparation of benazepril RANBAXY LABORATORIES LIMITED (IN) 2005-07-19 US disclosed
WO-2005010028-A1 ALPHA-AMINO ACID BENZOTHIAZOLYLTHIO ESTER AS INTERMEDIATES FOR MANUFACTURE OF ACE INHIBITORS AND PROCESS FOR PREPARATION THEREOF LUPIN LIMITED (IN) 2005-02-03 WO disclosed
US-20040152889-A1 Process for the preparation of benazepril RANBAXY LABORATORIES LIMITED (IN) 2004-08-05 US disclosed
US-4999370-A ANXIOLYTIC AGENTS, INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME, NOOTROPIC AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1991-03-12 US disclosed
EP-0161801-B1 PERHYDROTHIAZEPINE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANKYO COMPANY LIMITED (JP) 1990-11-07 EP disclosed
US-4808713-A Anthypertensive pyridazo [1,2-a][1,2]diazepines HOFFMAN-LA ROCHE INC. (US) 1989-02-28 US disclosed
US-4772701-A Pyridazo[1,2]pyridazines and pyrazolo[1,2]pyridazines as antihypertensives HOFFMANN-LA ROCHE INC. (US) 1988-09-20 US disclosed
US-4734410-A Lactam derivatives and their use as hypotensive agents SANKYO COMPANY LIMITED (JP) 1988-03-29 US disclosed
US-4699905-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1987-10-13 US disclosed
US-4658024-A Pyrazolo [1,2-a][1,2]-diazepines useful as antihypertensives HOFFMANN-LA ROCHE INC. (US) 1987-04-14 US disclosed
EP-0161801-A2 Perhydrothiazepine derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1985-11-21 EP disclosed
US-4525301-A REACTING TRIFLUOROMETHANE SULFONIC ACID DERIVATIVES WITH AMINO ACID ESTERS HOECHST AKTIENGESELLSCHAFT (DE) 1985-06-25 US disclosed
US-4512924-A HYPOTENSIVE AGENTS HOFFMANN-LA ROCHE INC. (US) 1985-04-23 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 (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-20040152889-A1 Process for the preparation of benazepril ACE, ACE2, REN SMN1; SMN2 3400/4885ACE 1/4885MAPT 1533/4885
US-20200231554-A1 LIPOPHILIC MACROCYCLIC LIGANDS, COMPLEXES THEREOF, AND USES OF SAME LDLR, NPC1L1, LRP6 SMN1; SMN2 4820/4885ACE 2969/4885MAPT 3931/4885

“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.