SCHEMBL5328614

SCHEMBL5328614

CC(CNC(=O)OCc1ccccc1)c1ccc(OC(C)(C)C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.50
ADRB3 P13945 3/20 0.49
SYK P43405 1/20 0.47
PPARA Q07869 4/20 0.47
PPARD Q03181 1/20 0.47
CTSK P43235 5/20 0.46
CTSL P07711 3/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
ACHE P22303 1/20 0.46
CTSS P25774 3/20 0.45
CTSB P07858 2/20 0.45
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL5323605 0.88 BCL9 (0.47) PPARGADRB3SYKPPARAPPARD
SCHEMBL13073762 0.85 LMNA (0.55) SYKCTSKCTSLCTSSCTSB
SCHEMBL13073758 0.85 LMNA (0.55) SYKCTSKCTSLCTSSCTSB
SCHEMBL9765305 0.84 LMNA (0.51) SYKCTSKCTSLCTSSCTSB
SCHEMBL5323545 0.84 PPARG (0.43) PPARGADRB3SYKPPARAPPARD
SCHEMBL5328603 0.83 PPARG (0.49) PPARGADRB3PPARAPPARDCTSK
SCHEMBL9765290 0.82 PTPN1 (0.55) CTSKCA1CA2ACHECTSS
SCHEMBL6557654 0.82 CYP3A4 (0.49) SYKCTSKCTSLCTSSCTSB
SCHEMBL6185436 0.82 LMNA (0.49) SYKCTSKCTSLCTSSCTSB
SCHEMBL8079357 0.80 CYP3A4 (0.47) SYKCTSKCTSLCA1CA2

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