SCHEMBL9554149

SCHEMBL9554149

CCCCCCc1cn(C(=O)CC)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 8/20 0.49
AGTR2 P50052 7/20 0.49
PPARG P37231 4/20 0.42

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
SCHEMBL9534234 0.99 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9035175 0.96 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL9554153 0.94 AGTR1 (0.49) AGTR1AGTR2PPARG
SCHEMBL9534106 0.94 AGTR1 (0.49) AGTR1AGTR2PPARG
SCHEMBL9553962 0.93 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9530446 0.93 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9037298 0.93 AGTR1 (0.46) AGTR1AGTR2PPARG
SCHEMBL9554406 0.93 AGTR1 (0.47) AGTR1AGTR2PPARG
SCHEMBL9553642 0.92 AGTR1 (0.48) AGTR1AGTR2PPARG
SCHEMBL9705020 0.91 AGTR1 (0.42) AGTR1AGTR2PPARG

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
US-5238952-A Treating glaucoma disorders G. D. SEARLE & CO. (US) 1993-08-24 US disclosed
US-5087634-A N-substituted imidazol-2-one compounds for treatment of circulatory disorders G. D. SEARLE & CO. (US) 1992-02-11 US disclosed