SCHEMBL9038121

SCHEMBL9038121

CCCCc1cn(CC2CCCC2)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 10/20 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
SCHEMBL9036321 0.99 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9554184 0.97 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL9037593 0.97 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9554068 0.96 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9035954 0.94 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9036546 0.93 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL9035183 0.92 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL9554416 0.91 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL9036555 0.90 AGTR1 (0.60) AGTR1AGTR2
SCHEMBL7683448 0.90 AGTR1 (0.46) 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