SCHEMBL8109440

SCHEMBL8109440

CCCCc1cn(-c2ccccc2CC)c(=O)n1Cc1ccc(-c2ccncc2-c2nnn[nH]2)cc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 11/20 0.53
AGTR2 P50052 10/20 0.53

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
SCHEMBL8109391 0.98 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL9286323 0.97 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL8122328 0.95 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9287361 0.94 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9285695 0.93 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL9388554 0.93 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9287127 0.93 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL8115093 0.93 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9387311 0.92 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL9389324 0.92 AGTR1 (0.45) 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