SCHEMBL9533131

SCHEMBL9533131

CC(C)CCc1c(CF)n(C(C)(C)C)c(=O)n1Cc1ccc(-c2ccccc2C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 1/20 0.46
AGTR1 P30556 2/20 0.45
AGTR2 P50052 2/20 0.45
PPARG P37231 1/20 0.43

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
SCHEMBL9534250 0.91 BRS3 (0.49) BRS3AGTR1AGTR2PPARG
SCHEMBL9531747 0.90 BRS3 (0.46) BRS3AGTR1AGTR2PPARG
SCHEMBL9530900 0.90 PPARG (0.52) AGTR1AGTR2PPARG
SCHEMBL9531621 0.89 BRS3 (0.47) BRS3AGTR1AGTR2
SCHEMBL9555096 0.89 BRS3 (0.47) BRS3AGTR1AGTR2
SCHEMBL9554043 0.89 BRS3 (0.47) BRS3AGTR1AGTR2PPARG
SCHEMBL9531420 0.89 AGTR1 (0.48) BRS3AGTR1AGTR2PPARG
SCHEMBL9536641 0.89 BRS3 (0.47) BRS3AGTR1AGTR2PPARG
SCHEMBL9533625 0.89 AGTR1 (0.48) BRS3AGTR1AGTR2PPARG
SCHEMBL9533675 0.88 PPARG (0.46) BRS3AGTR1AGTR2PPARG

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-5238952-A Treating glaucoma disorders G. D. SEARLE & CO. (US) 1993-08-24 US disclosed
EP-0555331-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS. SEARLE & CO (US) 1993-08-18 EP disclosed
WO-1992007834-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1992-05-14 WO disclosed
US-5087634-A N-substituted imidazol-2-one compounds for treatment of circulatory disorders G. D. SEARLE & CO. (US) 1992-02-11 US disclosed