SCHEMBL7244666

SCHEMBL7244666

CCOC(=O)c1cc2cc(OCc3cc(OS(=O)(=O)c4ccccc4)ccc3Cl)ccc2n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
TDP1 Q9NUW8 4/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NOD2 Q9HC29 2/20 0.38
NOD1 Q9Y239 2/20 0.38
F10 P00742 2/20 0.38
MAOA P21397 1/20 0.38
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37
PPARG P37231 1/20 0.37
LGALS8 O00214 1/20 0.37
LGALS3 P17931 1/20 0.37
TP53 P04637 1/20 0.36
PTGS2 P35354 2/20 0.35
ABCB11 O95342 1/20 0.35
CCR2 P41597 2/20 0.35
TSHR P16473 2/20 0.35

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
SCHEMBL8385275 0.86 F10 (0.51) MAPTTDP1KDM4EALDH1A1MAPK1
SCHEMBL7470558 0.82 NOD2 (0.40) MAPTTDP1KDM4EALDH1A1MAPK1
SCHEMBL7244673 0.81 MAPT (0.39) MAPTTDP1KDM4EALDH1A1MAPK1
SCHEMBL7244670 0.81 MAPT (0.36) MAPTTDP1KDM4EALDH1A1MAPK1
SCHEMBL7468828 0.80 EDNRB (0.47) MAPTNOD2NOD1F10NPC1
SCHEMBL7252148 0.79 MCL1 (0.38) KDM4ENOD2NOD1F10MAOA
SCHEMBL7246776 0.79 EDNRB (0.43) MAPTTDP1KDM4EALDH1A1MAPK1
SCHEMBL7247001 0.78 MAPT (0.49) MAPTTDP1KDM4EALDH1A1MAPK1
SCHEMBL8387936 0.78 MAPT (0.47) MAPTTDP1MAPK1NOD2NOD1
SCHEMBL7461983 0.78 MAOB (0.46) MAPTMAPK1NOD2NOD1F10

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
US-6670388-B1 Fatty acid synthase inhibitors SMITHKLINE BEECHAM CORPORATION 2003-12-30 US disclosed
WO-2002000620-A1 FATTY ACID SYNTHASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-01-03 WO disclosed