SCHEMBL8123763

SCHEMBL8123763

CCCc1cn(-c2c(C)cccc2C(=O)O)c(=O)n1Cc1ccc(-c2cccnc2-c2nnn[nH]2)cc1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.43
AGTR2 P50052 2/20 0.43
PPARG P37231 2/20 0.42

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
SCHEMBL8120047 0.96 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8117323 0.94 AGTR1 (0.43) AGTR1AGTR2PPARG
SCHEMBL8117048 0.94 AGTR1 (0.43) AGTR1AGTR2PPARG
SCHEMBL8109867 0.93 PPARG (0.42) AGTR1AGTR2PPARG
SCHEMBL8107814 0.93 AGTR1 (0.42) AGTR1AGTR2PPARG
SCHEMBL8107364 0.93 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL8121456 0.92 PPARG (0.42) AGTR1AGTR2PPARG
SCHEMBL8118068 0.91 PPARG (0.39) AGTR1AGTR2PPARG
SCHEMBL8119092 0.91 AGTR1 (0.38) AGTR1AGTR2PPARG
SCHEMBL8116683 0.91 AGTR1 (0.44) 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