SCHEMBL9414232

SCHEMBL9414232

CCCCc1nc(=O)n(C)c(=O)n1Cc1ccccc1-c1ccccc1-c1nnn[nH]1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 13/20 0.38
AGTR2 P50052 13/20 0.38

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
SCHEMBL9414280 0.83 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL9580916 0.80 AGTR2 (0.56) AGTR1AGTR2
SCHEMBL9414217 0.78 AGTR1 (0.34) AGTR1AGTR2
SCHEMBL9418318 0.78 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL9414204 0.78 GAA (0.33)
SCHEMBL9414205 0.76 AGTR1 (0.35) AGTR1AGTR2
SCHEMBL7687011 0.76 AGTR1 (0.33) AGTR1AGTR2
SCHEMBL13097903 0.74 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL9414270 0.74 DPP4 (0.36)
SCHEMBL9030436 0.74 AGTR1 (0.60) 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-0589201-A1 Di- and triazindeones MERCK PATENT GmbH (DE) 1994-03-30 EP disclosed