SCHEMBL7015535

SCHEMBL7015535

COCn1nc(C)n(-c2ccccc2-c2ccc(C)cc2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
RAB9A P51151 5/20 0.44
NPC1 O15118 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
CYP2C19 P33261 1/20 0.42
POLB P06746 1/20 0.41
ROCK2 O75116 4/20 0.41
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL9486032 0.85 RAB9A (0.43) ALDH1A1RAB9ANPC1SMN1; SMN2CYP2C19
SCHEMBL7011158 0.80 MEN1 (0.39) ALDH1A1RAB9ANPC1SMN1; SMN2POLB
SCHEMBL7017759 0.71 CYP1A2 (0.43) ALDH1A1RAB9ANPC1SMN1; SMN2POLB
SCHEMBL23755005 0.69 PTGS1 (0.53) ALDH1A1RAB9APOLBMAPTGAA
SCHEMBL9486018 0.68 PTGDR2 (0.39) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL7010741 0.66 KCNN4 (0.39) ALDH1A1MAPTNPSR1
SCHEMBL24174132 0.64 MAPT (0.45) ALDH1A1SMN1; SMN2CYP2C19POLBMAPT
SCHEMBL23754873 0.60 PTGS1 (0.58) ALDH1A1SMN1; SMN2MAPTNPSR1LMNA
SCHEMBL10441170 0.60 ALDH1A1 (0.50) ALDH1A1RAB9ANPC1MAPT
SCHEMBL8036362 0.60 LMNA (0.50) ALDH1A1RAB9ANPC1SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520423-B1 Heterocyclic compounds, their production and use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-05-14 EP disclosed
US-6100252-A SPECIFIED COMPOUNDS INCLUDING METHYL 2-BUTYL-1-((2'-(2-OXO-3H-1,2,3,5-OXATHIADIAZOL-4-YL)BIPHENYL) METHYL)-BENZIMIDAZOLE-7-CARBOXYLATE; USE TO TREAT CIRCULATORY DISEASES SUCH AS HYPERTENSIVE DISEASES AND HEART DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-08-08 US disclosed
US-5883111-A STRONG AND LONG-LASTING ACTION BY ORAL ADMINISTRATION; HYPOTENSIVE AGENTS; CARDIOTONIC AGENTS; ALZHEIMER'S DISEASE; TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-16 US disclosed
US-5736555-A HYPOTENSIVE AGENTS; FDA ORANGE BOOK LISTED PATENT FOR AZILSARTAN MEDOXOMIL TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-04-07 US disclosed
US-5583141-A ADMINISTERING AS THERAPEUTIC AGENTS OF CIRCULATORY DISEASES; AZILSARTAN; ANGIOTENSIN II ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-10 US disclosed
US-5354766-A 2-Ethoxy-1-((2'(2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl) biphenyl-4-yl)methyl)benzimidazole-7-carboxylic acid; hypotensive agents; CNS activity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-10-11 US disclosed
EP-0520423-A2 Heterocyclic compounds, their production and use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-30 EP disclosed