SCHEMBL8115127

SCHEMBL8115127

CCCCc1cn(-c2c(C(C)(C)C)cccc2C(C)(C)C)c(=O)n1Cc1ccc(-c2cccnc2-c2nnn[nH]2)cc1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 12/20 0.48
AGTR2 P50052 11/20 0.48

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
SCHEMBL8107290 0.96 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL8117891 0.96 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL8106158 0.96 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL8124024 0.95 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL8118922 0.95 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL8119332 0.95 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL8121125 0.95 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL8123879 0.94 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL8117294 0.94 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8116224 0.94 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
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