SCHEMBL9705540

SCHEMBL9705540

CCCn1c(C(=O)O)c(CCC(C)C)n(Cc2ccc(-c3ccccc3)c(-c3nnn[nH]3)c2)c1=O

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.36
AGTR2 P50052 3/20 0.35

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
SCHEMBL9705505 0.93 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL9036171 0.92 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9733919 0.91 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9705085 0.88 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9036184 0.87 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL9034866 0.87 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL9035125 0.87 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9035543 0.85 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL9034811 0.85 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL9554188 0.85 AGTR1 (0.41) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992007834-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1992-05-14 WO disclosed