SCHEMBL9704971

SCHEMBL9704971

CCCc1c(C)n(CCC)c(=O)n1Cc1ccc(-c2ccccc2)c(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.45
FOLH1 Q04609 1/20 0.45
AGTR1 P30556 1/20 0.45
AGTR2 P50052 1/20 0.45
LTB4R Q15722 1/20 0.42
LTB4R2 Q9NPC1 1/20 0.42

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
SCHEMBL9705420 0.90 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL9704928 0.89 PPARG (0.47) PPARGFOLH1AGTR1AGTR2
SCHEMBL9532889 0.88 AGTR1 (0.57) PPARGAGTR1AGTR2
SCHEMBL9705122 0.88 PPARG (0.42) PPARGFOLH1AGTR1AGTR2
SCHEMBL9705196 0.84 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9705068 0.83 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9036172 0.82 AGTR1 (0.63) PPARGAGTR1AGTR2
SCHEMBL9533795 0.82 PPARG (0.57) PPARGAGTR1AGTR2
SCHEMBL9554165 0.82 AGTR1 (0.63) AGTR1AGTR2
SCHEMBL9532126 0.82 PPARG (0.58) 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 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