SCHEMBL9532350

SCHEMBL9532350

CC(C)CCc1c(C(F)(F)F)n(CCC2CCCCC2)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.45
AGTR2 P50052 3/20 0.45

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
SCHEMBL9531587 0.94 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9554171 0.92 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9554272 0.92 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9532268 0.91 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL9554527 0.91 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9532484 0.91 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9034970 0.91 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL9530314 0.90 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL9531121 0.90 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL9036337 0.89 AGTR1 (0.39) 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 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