SCHEMBL8119230

SCHEMBL8119230

CCCCc1cn(-c2c(C(C)=O)cccc2C(C)C)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cn1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 12/20 0.49
AGTR2 P50052 10/20 0.49
BRS3 P32247 2/20 0.33

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
SCHEMBL8117303 0.96 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL8107722 0.94 AGTR1 (0.49) AGTR1AGTR2BRS3
SCHEMBL8122962 0.94 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL8110673 0.92 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL8131365 0.92 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL6503642 0.91 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL8106185 0.91 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL8115161 0.91 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL8107742 0.90 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL8118061 0.90 AGTR1 (0.44) AGTR1AGTR2BRS3

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 2 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
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