SCHEMBL9036320

SCHEMBL9036320

CCCCc1cn(CC(CC)CCC)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 10/20 0.55
AGTR2 P50052 9/20 0.55

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
SCHEMBL9035139 0.96 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL9036041 0.90 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL9035928 0.88 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL9553899 0.87 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL9036396 0.87 AGTR1 (0.66) AGTR1AGTR2
Sc-51895 SCHEMBL6568041 0.87 AGTR1 (0.71) AGTR1AGTR2
SCHEMBL9036027 0.87 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL9555359 0.87 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9036019 0.87 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL9036005 0.86 AGTR1 (0.68) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0555331-B1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS SEARLE & CO (US) 1996-04-24 EP claimed