SCHEMBL4740499

SCHEMBL4740499

Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)CCc1ccc(OC(C)(C)C(=O)O)c(Cl)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.55
PPARD Q03181 5/20 0.55
MAPT P10636 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 1/20 0.52
RAB9A P51151 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
NPC1 O15118 2/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.47
NPY1R P25929 1/20 0.46
NPY2R P49146 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PPARG P37231 2/20 0.44
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42

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
SCHEMBL4738822 0.93 PPARA (0.55) PPARAPPARDMAPTMEN1KMT2A
SCHEMBL4741580 0.91 PPARA (0.56) PPARAPPARDALDH1A1NPC1GAA
SCHEMBL14146453 0.90 MAPT (0.49) PPARAPPARDMAPTMEN1KMT2A
SCHEMBL4737357 0.85 MAPT (0.43) PPARAPPARDMAPTALDH1A1RAB9A
SCHEMBL4739679 0.84 PPARA (0.57) PPARAPPARDMAPTMEN1KMT2A
SCHEMBL14146355 0.83 PPARA (0.45) PPARAPPARDMAPTMEN1KMT2A
SCHEMBL14146341 0.83 PPARA (0.47) PPARAPPARDMAPTMEN1KMT2A
SCHEMBL14146844 0.82 PPARA (0.51) PPARAPPARDMAPTALDH1A1NPC1
SCHEMBL14146852 0.82 PPARA (0.52) PPARAPPARDALDH1A1NPC1GAA
SCHEMBL4739681 0.81 MAPT (0.61) PPARAPPARDMAPTMEN1KMT2A

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 3 patents. 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 claimed
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
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