SCHEMBL9531305

SCHEMBL9531305

CC(C)CCn1cc(CC(C)C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c1=O

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.48
AGTR2 P50052 4/20 0.48
PPARG P37231 2/20 0.46
LTB4R2 Q9NPC1 1/20 0.44
BRS3 P32247 1/20 0.44

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
SCHEMBL9531066 0.92 AGTR1 (0.52) AGTR1AGTR2PPARG
SCHEMBL9530179 0.92 AGTR1 (0.50) AGTR1AGTR2PPARG
SCHEMBL9532974 0.92 AGTR1 (0.50) AGTR1AGTR2PPARGBRS3
SCHEMBL9553837 0.91 AGTR1 (0.49) AGTR1AGTR2PPARG
SCHEMBL9530967 0.91 AGTR1 (0.48) AGTR1AGTR2PPARGLTB4R2
SCHEMBL9037103 0.90 AGTR1 (0.58) AGTR1AGTR2PPARG
SCHEMBL9531131 0.90 PPARG (0.56) AGTR1AGTR2PPARG
SCHEMBL9530965 0.90 PPARG (0.50) AGTR1AGTR2PPARG
SCHEMBL9531958 0.90 AGTR1 (0.48) AGTR1AGTR2PPARGLTB4R2
SCHEMBL9533797 0.89 AGTR1 (0.55) AGTR1AGTR2PPARG

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