SCHEMBL4033955

SCHEMBL4033955

Cc1ccc(-c2cccc(OC(C)(C)C(=O)O)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.54
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
TSHR P16473 1/20 0.50
FFAR4 Q5NUL3 1/20 0.49
PPARG P37231 7/20 0.49
PPARA Q07869 6/20 0.49
CYP2C19 P33261 3/20 0.49
CYP1A2 P05177 2/20 0.49
MAPT P10636 2/20 0.49
CYP2C9 P11712 1/20 0.48
PPARD Q03181 1/20 0.48
RXRA P19793 2/20 0.46
RXRB P28702 2/20 0.46
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
PTPN7 P35236 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
SCHEMBL8264617 0.85 PPARA (0.55) MAP4K4MEN1KMT2AKDM4EALDH1A1
SCHEMBL3484948 0.84 CYP1A2 (0.46) MAP4K4FFAR4PPARGPPARACYP2C19
SCHEMBL4036305 0.84 PPARA (0.62) MAP4K4MEN1KMT2AKDM4EALDH1A1
SCHEMBL4035971 0.83 MAP4K4 (0.53) MAP4K4MEN1KMT2AKDM4EALDH1A1
SCHEMBL3484032 0.83 PPARA (0.57) TSHRFFAR4PPARGPPARACYP2C19
SCHEMBL9911068 0.82 PPARG (0.55) MAP4K4MEN1KMT2AKDM4EALDH1A1
SCHEMBL4040746 0.82 PPARG (0.55) MEN1KMT2AFFAR4PPARGPPARA
SCHEMBL11399949 0.79 PPARG (0.57) ALDH1A1PPARGPPARA
SCHEMBL9416379 0.79 PPARA (0.65) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL4039835 0.78 PPARG (0.46) MAP4K4MEN1KMT2APPARGPPARA

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
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
WO-2008012470-A2 SUBSTITUTED IMIDAZOLONE DERIVATIVES, PREPARATION AND USES GENFIT (FR) 2008-01-31 WO disclosed