SCHEMBL7299259

SCHEMBL7299259

CCCc1nc2c(C(C)C)cc(N3Cc4ccccc4C3=O)cc2n1Cc1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.53
AGTR1 P30556 9/20 0.39
AGTR2 P50052 2/20 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
SCHEMBL8848098 0.93 PPARG (0.44) PPARGAGTR1AGTR2
SCHEMBL7306018 0.90 PPARG (0.56) PPARGAGTR1AGTR2
SCHEMBL7306163 0.90 PPARG (0.56) PPARGAGTR1AGTR2
SCHEMBL7309361 0.86 PPARG (0.50) PPARGAGTR1AGTR2
SCHEMBL7311921 0.85 AGTR1 (0.41) AGTR1
SCHEMBL8942730 0.77 PPARG (0.61) PPARGAGTR1AGTR2
SCHEMBL682573 0.76 PPARG (0.65) PPARGAGTR1AGTR2
SCHEMBL7310654 0.76 PPARG (0.65) PPARGAGTR1AGTR2
SCHEMBL7313039 0.76 PPARG (0.56) PPARGAGTR1AGTR2
SCHEMBL7310663 0.76 PPARG (0.50) PPARGAGTR1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5614519-A (1-(2,3 or 4-N-morpholinoalkyl)-imidazol-4-yl)-benizimidazol-1-yl-methyl]-biphenyls useful as angiotensin-II antagonists KARL THOMAE GMBH (DE) 1997-03-25 US disclosed
US-5594003-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-14 US disclosed
US-5591762-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
EP-0502314-A1 Benzimidazol, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-09 EP disclosed