SCHEMBL4039835

SCHEMBL4039835

Cc1ccc(Sc2cccc(OC(C)(C)C(=O)O)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.46
PPARA Q07869 12/20 0.46
PTPN7 P35236 1/20 0.45
DUSP3 P51452 1/20 0.45
PTPN12 Q05209 1/20 0.45
PTPN22 Q9Y2R2 1/20 0.45
BCL9 O00512 1/20 0.42
CTNNB1 P35222 1/20 0.42
CYP2C19 P33261 2/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
PPARD Q03181 3/20 0.40
CYP2C9 P11712 1/20 0.39
MAP4K4 O95819 1/20 0.38

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
SCHEMBL3484278 0.85 PPARG (0.39) PPARGPPARAMAPTMTNR1AMTNR1B
SCHEMBL4035957 0.84 PPARG (0.48) PPARGPPARAPTPN7DUSP3PTPN12
SCHEMBL9911068 0.79 PPARG (0.55) PPARGPPARAPTPN7DUSP3PTPN12
SCHEMBL4033955 0.78 MAP4K4 (0.54) PPARGPPARAPTPN7DUSP3PTPN12
SCHEMBL4040746 0.78 PPARG (0.55) PPARGPPARAPTPN7DUSP3PTPN12
SCHEMBL13049316 0.77 LMNA (0.60) MEN1CYP3A4MAPTKMT2AMTNR1A
SCHEMBL11399949 0.76 PPARG (0.57) PPARGPPARA
SCHEMBL1045831 0.75 PPARA (0.69) PPARGPPARACYP2C19MEN1CYP1A2
SCHEMBL4037839 0.75 PPARG (0.44) PPARGPPARAPTPN7DUSP3PTPN12
SCHEMBL3845579 0.74 PPARG (0.56) PPARGPPARAPTPN7DUSP3PTPN12

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
EP-2049107-A2 SUBSTITUTED IMIDAZOLONE DERIVATIVES, PREPARATION AND USES Genfit (FR) 2009-04-22 EP disclosed
WO-2008012470-A2 SUBSTITUTED IMIDAZOLONE DERIVATIVES, PREPARATION AND USES GENFIT (FR) 2008-01-31 WO disclosed