SCHEMBL8123990

SCHEMBL8123990

CCCCc1cn(-c2c(C(C)=O)cccc2C(C)C)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)nc1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 14/20 0.66
AGTR2 P50052 13/20 0.66
BRS3 P32247 1/20 0.34

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
SCHEMBL8122826 0.96 AGTR1 (0.60) AGTR1AGTR2
SCHEMBL8122234 0.94 AGTR1 (0.66) AGTR1AGTR2BRS3
SCHEMBL8108495 0.93 AGTR1 (0.76) AGTR1AGTR2
SCHEMBL8117868 0.91 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL8116210 0.91 AGTR1 (0.66) AGTR1AGTR2
SCHEMBL8119619 0.90 AGTR1 (0.60) AGTR1AGTR2
SCHEMBL8124281 0.90 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL8118358 0.90 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL8107012 0.90 AGTR1 (0.70) AGTR1AGTR2
SCHEMBL8122771 0.90 AGTR1 (0.70) 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 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