SCHEMBL8116604

SCHEMBL8116604

CCCc1cn(-c2c(Br)cccc2C(C)(C)C)c(=O)n1Cc1ccc(-c2ccncc2-c2nnn[nH]2)cc1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.39
AGTR2 P50052 5/20 0.39

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
SCHEMBL8114569 0.98 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL8114667 0.96 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL8106832 0.95 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL8122759 0.93 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL8117905 0.92 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL8109523 0.92 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL8121169 0.92 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL8117536 0.92 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL8114674 0.92 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL6502247 0.92 AGTR1 (0.42) 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
EP-0664802-B1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS SEARLE & CO (US) 2000-03-15 EP disclosed
EP-0664802-A1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1995-08-02 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