SCHEMBL6470962

SCHEMBL6470962

COC(=O)c1ccc(-c2c[nH]c(=O)c(Cl)c2OCc2ccc(F)cc2F)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.43
MAPK14 Q16539 11/20 0.42
SGK1 O00141 1/20 0.40
CAMKK2 Q96RR4 1/20 0.40
MAPK11 Q15759 1/20 0.40
PTPN7 P35236 1/20 0.39
MAP2K4 P45985 1/20 0.39
RET P07949 1/20 0.38
PTGS1 P23219 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 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
SCHEMBL6471156 0.78 MAPK14 (0.41) MAOBMAPK14
SCHEMBL4377468 0.77 MAPK14 (0.43) MAOBMAPK14MAPK11
SCHEMBL6473862 0.77 MAPK14 (0.44) MAOBMAPK14MAPK11
SCHEMBL6470956 0.77 MAPK14 (0.44) MAOBMAPK14RET
SCHEMBL4379189 0.76 MAPK14 (0.47) MAOBMAPK14MAPK11
SCHEMBL6472105 0.76 MAPK14 (0.41) MAOBMAPK14MAPK11
SCHEMBL6470945 0.75 MAPK14 (0.47) MAOBMAPK14MAPK11MAP2K4NPC1
SCHEMBL6471273 0.75 MAPK14 (0.44) MAOBMAPK14
SCHEMBL6533063 0.74 MAPK14 (0.42) MAOBMAPK14MAPK11RET
SCHEMBL6470939 0.73 MAPK14 (0.41) MAOBMAPK14MAPK11

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-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO disclosed