SCHEMBL5323545

SCHEMBL5323545

Cc1cc(OC(C)(C)C(=O)O)ccc1C(C)CNC(=O)OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.43
PPARA Q07869 4/20 0.43
PPARD Q03181 3/20 0.43
SYK P43405 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
CTSK P43235 5/20 0.41
CTSS P25774 2/20 0.41
CTSL P07711 2/20 0.41
CTSB P07858 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MAPT P10636 1/20 0.41
ELANE P08246 1/20 0.41
PRTN3 P24158 1/20 0.41
ADRB3 P13945 1/20 0.41

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
SCHEMBL5328614 0.84 PPARG (0.50) PPARGPPARAPPARDSYKL3MBTL1
SCHEMBL5323605 0.83 BCL9 (0.47) PPARGPPARAPPARDSYKCTSK
SCHEMBL5323594 0.76 PPARA (0.46) PPARGPPARAPPARDMAPT
SCHEMBL5320648 0.76 PPARA (0.46) PPARGPPARAPPARDMAPT
SCHEMBL5325698 0.75 PPARA (0.43) PPARGPPARAPPARDMAPT
SCHEMBL9765283 0.73 LMNA (0.45) SYKL3MBTL1CTSKCTSSCTSL
SCHEMBL13073762 0.73 LMNA (0.55) SYKCTSKCTSSCTSLCTSB
SCHEMBL13073758 0.73 LMNA (0.55) SYKCTSKCTSSCTSLCTSB
SCHEMBL5328603 0.72 PPARG (0.49) PPARGPPARAPPARDCTSKCTSS
SCHEMBL28746806 0.71 LMNA (0.56) SYKL3MBTL1CTSKCTSSCTSL

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
WO-2007118964-A1 SUBSTITUTED N-(PHENETHYL)BENZAMIDE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-10-25 WO disclosed
WO-2007118963-A2 SUBSTITUTED N-(PHENETHYL)BENZAMIDE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-10-25 WO disclosed