SCHEMBL6890597

SCHEMBL6890597

CCN(OCc1ccccc1)C(=O)C(Cc1ccc(OCc2ccccc2)cc1)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 4/20 0.46
▸ L3MBTL1 Q9Y468 4/20 0.46
▸ ALOX5 P09917 2/20 0.44
▸ PPARG P37231 4/20 0.43
▸ PPARA Q07869 3/20 0.43
▸ PPARD Q03181 1/20 0.43
▸ ITGB3 P05106 1/20 0.43
▸ ITGA2B P08514 1/20 0.43
▸ LTA4H P09960 2/20 0.42
▸ BCHE P06276 1/20 0.41

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
SCHEMBL29397771 0.85 ITGB3 (0.55) MAOBALOX5PPARGPPARAPPARD
SCHEMBL16634946 0.85 ITGB3 (0.55) MAOBALOX5PPARGPPARAPPARD
SCHEMBL6474783 0.85 ITGB3 (0.55) MAOBALOX5PPARGPPARAPPARD
SCHEMBL20693061 0.85 MAOB (0.48) MAOBALOX5PPARGPPARAPPARD
SCHEMBL18918265 0.83 LTA4H (0.52) MAOBALOX5PPARGPPARAPPARD
SCHEMBL20693059 0.79 ALOX5 (0.49) MAOBL3MBTL1ALOX5PPARGPPARA
SCHEMBL6890932 0.78 PSMB1 (0.49) MAOB
SCHEMBL6890928 0.78 PSMB1 (0.49) MAOB
SCHEMBL6326103 0.77 REN (0.45) L3MBTL1
SCHEMBL6890591 0.77 EPOR (0.52) MAOBL3MBTL1ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6737410-B1 SMOOTH MUSCLE ANTIPROLIFERATION AGENTS; SUCH AS 1-((2-(4-BENZYLOXY-PHENYL)-1-PHENETHYLCARBAMOYL-ETHYL)-METHYL-CARBAMOYL)-2 -(1H-IMIDAZOL-4-YL)-ETHYL)-CARBAMIC ACID BENZYL ESTER WARNER-LAMBERT COMPANY 2004-05-18 — — US disclosed
US-6265382-B1 E.G., (S--(R*, R*))-(1-((2-(4-BENZYLOXY-PHENYL)-1-PHENETHYLCARBAMOYL-ETHYL)-M ETHYL-CARBAM OYL)-2-(1H-IMIDAZOL-4-YL)-ETHYL)-CARBAMIC ACID BENZYL ESTER WARNER-LAMBERT COMPANY 2001-07-24 — — US disclosed
Send feedback