SCHEMBL9705028

SCHEMBL9705028

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

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 11/20 0.41
AGTR2 P50052 11/20 0.41

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
SCHEMBL9705495 0.95 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL9035800 0.90 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9734718 0.90 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL9706047 0.89 GP6 (0.40) AGTR1AGTR2
SCHEMBL9733919 0.89 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9733501 0.88 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL9705108 0.87 ADORA2A (0.35) AGTR1AGTR2
SCHEMBL9035423 0.86 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9733915 0.86 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9706069 0.86 AGTR1 (0.43) 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
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