SCHEMBL9414280

SCHEMBL9414280

CCCCc1cc(=O)n(C)c(=O)n1Cc1ccccc1-c1ccccc1-c1nnn[nH]1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.40
AGTR2 P50052 7/20 0.40

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
SCHEMBL9414217 0.94 AGTR1 (0.34) AGTR1AGTR2
SCHEMBL9414205 0.88 AGTR1 (0.35) AGTR1AGTR2
SCHEMBL9414232 0.83 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL9414216 0.82 AGTR1 (0.32) AGTR1AGTR2
SCHEMBL9414259 0.82 HPGD (0.35)
SCHEMBL9414237 0.80 AGTR1 (0.34) AGTR1AGTR2
SCHEMBL9414234 0.80 GAA (0.31)
SCHEMBL9414270 0.80 DPP4 (0.36)
SCHEMBL9414231 0.79 PPARG (0.38)
SCHEMBL9414271 0.78 KMT2A (0.33)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0589201-A1 Di- and triazindeones MERCK PATENT GmbH (DE) 1994-03-30 EP claimed
EP-0589201-A1 Di- and triazindeones MERCK PATENT GmbH (DE) 1994-03-30 EP disclosed