SCHEMBL19831041

SCHEMBL19831041

COc1ccc(C(=O)c2c(C(=O)O)n(-c3ccc(Cl)cc3)c3cc(Cl)ccc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 7/20 0.52
HPGD P15428 1/20 0.52
MAPT P10636 1/20 0.48
RAB9A P51151 1/20 0.48
USP14 P54578 1/20 0.48
PPARG P37231 3/20 0.46
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPK9 P45984 1/20 0.43
MEN1 O00255 1/20 0.43
PKM P14618 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL19831033 0.90 MAPK8 (0.45) MAPK8USP14PPARGMAPK9
SCHEMBL19831040 0.87 MAPK8 (0.52) MAPK8HPGDMAPTRAB9AUSP14
SCHEMBL19831088 0.85 ENPP2 (0.48) MAPK8MAPTPPARGMAPK9MEN1
SCHEMBL19831224 0.84 MAPK8 (0.48) MAPK8PPARGPOLBKDM4EMEN1
SCHEMBL19831116 0.82 MAPK8 (0.45) MAPK8USP14PPARGMAPK9
SCHEMBL19831198 0.82 PPARG (0.48) MAPK8HPGDMAPTRAB9APPARG
SCHEMBL19831112 0.81 MAPK8 (0.42) MAPK8USP14PPARGMAPK9
SCHEMBL19831032 0.79 MAPK1 (0.52) MAPK8HPGDUSP14KDM4EMAPK9
SCHEMBL19831246 0.79 MAPK8 (0.41) MAPK8USP14PPARGMAPK9
SCHEMBL19831090 0.78 SMN1; SMN2 (0.46) MAPK8PPARGPOLBMAPK9MEN1

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
WO-2018021762-A1 NOVEL COMPOUND, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME 현대약품 주식회사 2018-02-01 WO disclosed