SCHEMBL8111069

SCHEMBL8111069

CCCc1cn(-c2c(OC)cccc2C(C)(C)C)c(=O)n1Cc1ccc(-c2cnccc2-c2nnn[nH]2)cc1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.38
AGTR2 P50052 5/20 0.38
APLNR P35414 1/20 0.32

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
SCHEMBL8118169 0.98 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL8116450 0.96 AGTR1 (0.43) AGTR1AGTR2APLNR
SCHEMBL8116607 0.94 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL8117223 0.94 AGTR1 (0.43) AGTR1AGTR2APLNR
SCHEMBL8117905 0.93 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL6501583 0.93 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL8124531 0.92 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL8115937 0.91 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL8115075 0.91 AGTR1 (0.42) AGTR1AGTR2APLNR
SCHEMBL8117850 0.91 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664802-B1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS SEARLE & CO (US) 2000-03-15 EP disclosed
WO-1994008990-A1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1994-04-28 WO disclosed