SCHEMBL8116458

SCHEMBL8116458

CCCc1cn(-c2c(C)cccc2Br)c(=O)n1Cc1ccc(-c2cnccc2-c2nnn[nH]2)cc1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.43
AGTR2 P50052 6/20 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
SCHEMBL8123627 0.98 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL8109988 0.95 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL8125437 0.94 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8123347 0.93 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8108302 0.92 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL8115148 0.92 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL8117892 0.92 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL6501755 0.92 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL8106818 0.92 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL8115103 0.92 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 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