SCHEMBL9528882

SCHEMBL9528882

CCCc1c(C=O)n(CC2CCCCC2)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 5/20 0.44
AGTR1 P30556 4/20 0.44
SLC33A1 O00400 1/20 0.41
GP6 Q9HCN6 1/20 0.39

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
SCHEMBL9530342 0.96 AGTR1 (0.48) AGTR2AGTR1GP6
SCHEMBL9554414 0.92 AGTR2 (0.39) AGTR2AGTR1SLC33A1GP6
SCHEMBL9553934 0.92 AGTR2 (0.50) AGTR2AGTR1GP6
SCHEMBL9554922 0.89 AGTR1 (0.46) AGTR2AGTR1SLC33A1
SCHEMBL9529767 0.89 AGTR1 (0.46) AGTR2AGTR1SLC33A1
SCHEMBL9531792 0.89 AGTR1 (0.45) AGTR2AGTR1SLC33A1
SCHEMBL9554373 0.88 AGTR1 (0.54) AGTR2AGTR1GP6
SCHEMBL9035154 0.88 AGTR2 (0.47) AGTR2AGTR1GP6
SCHEMBL9553738 0.88 AGTR2 (0.45) AGTR2AGTR1GP6
SCHEMBL9553752 0.88 AGTR1 (0.45) AGTR2AGTR1SLC33A1

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 4 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
EP-0555331-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS. SEARLE & CO (US) 1993-08-18 EP disclosed
WO-1992007834-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1992-05-14 WO 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