SCHEMBL9554184

SCHEMBL9554184

CCCCCc1cn(CC2CCCCC2)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.52
AGTR2 P50052 7/20 0.52
PPARG P37231 1/20 0.41

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
SCHEMBL9554068 0.99 AGTR1 (0.51) AGTR1AGTR2PPARG
SCHEMBL9036321 0.98 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9038121 0.97 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9035954 0.94 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9037593 0.94 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9554207 0.93 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9532766 0.92 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9554416 0.91 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL7681536 0.91 AGTR1 (0.42) AGTR1AGTR2PPARG
SCHEMBL7679141 0.91 AGTR1 (0.44) 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 3 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
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