SCHEMBL9705512

SCHEMBL9705512

CCCn1c(C(F)(F)F)c(CCC(C)C)n(Cc2ccc(-c3ccccc3)c(C(=O)O)c2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.41
AGTR1 P30556 2/20 0.40
AGTR2 P50052 2/20 0.40
PPARG P37231 2/20 0.39
BRS3 P32247 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
SCHEMBL9554009 0.90 AGTR1 (0.50) AGTR1AGTR2PPARG
SCHEMBL9034954 0.85 AGTR1 (0.55) AGTR1AGTR2PPARG
SCHEMBL9705325 0.85 AGTR1 (0.40) FOLH1AGTR1AGTR2PPARGBRS3
SCHEMBL9554548 0.85 AGTR1 (0.47) AGTR1AGTR2PPARGBRS3
SCHEMBL9553882 0.84 AGTR1 (0.52) AGTR1AGTR2PPARG
SCHEMBL9554788 0.83 PPARG (0.47) AGTR1AGTR2PPARGBRS3
SCHEMBL9531336 0.83 PPARG (0.51) AGTR1AGTR2PPARG
SCHEMBL9555014 0.83 PPARG (0.49) AGTR1AGTR2PPARG
SCHEMBL9532720 0.83 PPARG (0.48) AGTR1AGTR2PPARGBRS3
SCHEMBL9534445 0.82 AGTR1 (0.55) AGTR1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992007834-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1992-05-14 WO disclosed