SCHEMBL7244673

SCHEMBL7244673

CCOC(=O)c1cc2cc(OC(OS(=O)(=O)c3ccccc3)c3ccccc3Cl)ccc2n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NOD2 Q9HC29 2/20 0.38
NOD1 Q9Y239 2/20 0.38
PTGS2 P35354 2/20 0.35
F10 P00742 2/20 0.35
CCR2 P41597 2/20 0.35
MAOA P21397 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TP53 P04637 1/20 0.34
TSHR P16473 2/20 0.34
POLB P06746 1/20 0.34
ATM Q13315 1/20 0.34
ABCB11 O95342 1/20 0.34
LGALS8 O00214 1/20 0.34

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
SCHEMBL7244666 0.81 MAPT (0.39) MAPTALDH1A1TDP1KDM4EMAPK1
SCHEMBL7470558 0.79 NOD2 (0.40) MAPTALDH1A1TDP1KDM4EMAPK1
SCHEMBL8385275 0.79 F10 (0.51) MAPTALDH1A1TDP1KDM4EMAPK1
SCHEMBL7247001 0.76 MAPT (0.49) MAPTALDH1A1TDP1KDM4EMAPK1
SCHEMBL7246776 0.75 EDNRB (0.43) MAPTALDH1A1TDP1KDM4EMAPK1
SCHEMBL7493053 0.75 NOD2 (0.45) MAPTALDH1A1TDP1KDM4EMAPK1
SCHEMBL7252149 0.75 NOD2 (0.35) MAPTALDH1A1TDP1NOD2NOD1
SCHEMBL7468828 0.74 EDNRB (0.47) MAPTNOD2NOD1PTGS2F10
SCHEMBL7463568 0.73 NOD2 (0.43) MAPTALDH1A1TDP1KDM4EMAPK1
SCHEMBL7496568 0.73 MAPT (0.44) MAPTALDH1A1TDP1KDM4EMAPK1

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