SCHEMBL9690284

SCHEMBL9690284

COc1ccc2c(O)c(-c3ccccc3)c(=O)n(Cc3ccc(-c4ccccc4C#N)cc3)c2c1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.46
KCNA5 P22460 2/20 0.46
KCNH2 Q12809 1/20 0.46
ALOX5AP P20292 1/20 0.44
PPARG P37231 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PLA2G2A P14555 1/20 0.43
EGLN1 Q9GZT9 2/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL9690123 0.91 ALOX5AP (0.46) ALOX5APPPARGMEN1KMT2A
SCHEMBL9690851 0.86 PPARG (0.44) ALOX5APPPARG
SCHEMBL9531841 0.85 PPARG (0.52) MAPK8PPARGPLA2G2A
SCHEMBL9536684 0.84 MAPK8 (0.55) MAPK8PPARGPLA2G2AEGLN1HDAC1
SCHEMBL9531601 0.80 MAPK8 (0.43) MAPK8PLA2G2AEGLN1HDAC1HDAC8
SCHEMBL9531997 0.79 PPARG (0.45) PPARG
SCHEMBL9531469 0.76 PPARG (0.49) PPARG
SCHEMBL9531904 0.74 PPARG (0.50) PPARGPLA2G2A
SCHEMBL14208362 0.73 PPARG (0.48) PPARG
SCHEMBL9530978 0.72 PPARG (0.51) PPARG

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-0500297-A1 Substituted pyridinones and pyrimidinones as angiotensin II antagonists FISONS plc (GB) 1992-08-26 EP disclosed