SCHEMBL9704951

SCHEMBL9704951

CCCCc1c(C=O)n(CCC(C)C)c(=O)n1Cc1ccc(-c2ccccc2)c(-c2nnn[nH]2)c1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GP6 Q9HCN6 1/20 0.38
AGTR2 P50052 10/20 0.36
AGTR1 P30556 9/20 0.36

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
SCHEMBL9706047 0.93 GP6 (0.40) GP6AGTR2AGTR1
SCHEMBL9704938 0.92 AGTR2 (0.40) GP6AGTR2AGTR1
SCHEMBL9035688 0.91 GP6 (0.44) GP6AGTR2AGTR1
SCHEMBL9705317 0.89 AGTR1 (0.37) AGTR2AGTR1
SCHEMBL9036532 0.86 AGTR2 (0.42) GP6AGTR2AGTR1
SCHEMBL9035938 0.85 GP6 (0.43) GP6AGTR2AGTR1
SCHEMBL9705108 0.85 ADORA2A (0.35) AGTR2AGTR1
SCHEMBL9036890 0.85 AGTR2 (0.38) GP6AGTR2AGTR1
SCHEMBL9035246 0.84 AGTR1 (0.43) GP6AGTR2AGTR1
SCHEMBL9035747 0.84 GP6 (0.47) GP6AGTR2AGTR1

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