SCHEMBL9554351

SCHEMBL9554351

CCn1c(C=O)c(CCC(C)C)n(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 6/20 0.40
GP6 Q9HCN6 1/20 0.40
AGTR1 P30556 6/20 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
SCHEMBL9036154 0.94 AGTR2 (0.40) AGTR2GP6AGTR1
SCHEMBL9034829 0.93 AGTR2 (0.40) AGTR2GP6AGTR1
SCHEMBL9529951 0.93 AGTR2 (0.38) AGTR2GP6AGTR1
SCHEMBL9036890 0.93 AGTR2 (0.38) AGTR2GP6AGTR1
SCHEMBL9035938 0.92 GP6 (0.43) AGTR2GP6AGTR1
SCHEMBL9553738 0.91 AGTR2 (0.45) AGTR2GP6AGTR1
SCHEMBL9035246 0.91 AGTR1 (0.43) AGTR2GP6AGTR1
SCHEMBL9036021 0.91 AGTR1 (0.39) AGTR2GP6AGTR1
SCHEMBL9036532 0.90 AGTR2 (0.42) AGTR2GP6AGTR1
SCHEMBL9534310 0.90 AGTR2 (0.38) AGTR2GP6AGTR1

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 3 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
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