SCHEMBL8107020

SCHEMBL8107020

CCCCc1cn(-c2c(C)cccc2CCC)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)nc1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 14/20 0.68
AGTR2 P50052 12/20 0.68

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
SCHEMBL8115714 0.96 AGTR1 (0.69) AGTR1AGTR2
SCHEMBL8120989 0.96 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL30604713 0.95 AGTR1 (0.76) AGTR1AGTR2
SCHEMBL612578 0.95 AGTR1 (0.76) AGTR1AGTR2
SCHEMBL8119476 0.94 AGTR1 (0.72) AGTR1AGTR2
SCHEMBL8109576 0.93 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL8117864 0.92 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL8118112 0.92 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL8106925 0.92 AGTR1 (0.69) AGTR1AGTR2
SCHEMBL8123083 0.92 AGTR1 (0.75) 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