SCHEMBL4740738

SCHEMBL4740738

Cc1nc(-c2cccc(C(F)(F)F)c2)sc1C(=O)/C=C/c1ccc(O)c(Cl)c1Cl

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
MAPT P10636 8/20 0.48
KMT2A Q03164 6/20 0.48
MEN1 O00255 4/20 0.48
LMNA P02545 3/20 0.48
RAB9A P51151 3/20 0.47
ATM Q13315 1/20 0.47
NPC1 O15118 3/20 0.44
HPGD P15428 1/20 0.44
PPARA Q07869 2/20 0.44
XDH P47989 1/20 0.39
GAA P10253 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
NR1H4 Q96RI1 1/20 0.39

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
SCHEMBL4740739 1.00 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL4740506 0.89 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL4740490 0.89 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL14146446 0.84 MAPT (0.48) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL4740502 0.81 MAPT (0.62) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL4740504 0.81 MAPT (0.62) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL219716 0.79 HDAC6 (0.43) MAPT
SCHEMBL4740526 0.79 MAPT (0.67) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL4740529 0.79 MAPT (0.67) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL219717 0.79 HDAC6 (0.43) MAPT

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-2008087367-A2 SUBSTITUTED (PHENYLTHIAZOLYL)-PHENYL-PROPAN-1-ONE AND (PHENYLOXAZODYL)-PHENYL-PROPAN-1-ONE DERIVATIVES, PREPARATIONS AND USES OF SAME GENFIT (FR) 2008-07-24 WO disclosed