SCHEMBL8115455

SCHEMBL8115455

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

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.36
AGTR2 P50052 4/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL8109013 0.98 AGTR1 (0.36) AGTR1AGTR2PPARG
SCHEMBL8122724 0.96 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL8123999 0.94 PPARG (0.41) AGTR1AGTR2PPARG
SCHEMBL8124364 0.94 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL8119033 0.93 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL8117505 0.92 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL8123890 0.92 PPARG (0.41) AGTR1AGTR2PPARG
SCHEMBL8106957 0.92 AGTR1 (0.41) AGTR1AGTR2PPARG
SCHEMBL8123528 0.92 AGTR1 (0.36) AGTR1AGTR2PPARG
SCHEMBL6501716 0.92 PPARG (0.41) AGTR1AGTR2PPARG

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