SCHEMBL4033117

SCHEMBL4033117

CC(C)(Oc1ccc(Sc2ccc(CBr)cc2)cc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.60
PPARG P37231 11/20 0.60
MEN1 O00255 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
MAPT P10636 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 1/20 0.51
PPARD Q03181 3/20 0.47
TBXAS1 P24557 2/20 0.47
LMNA P02545 2/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
BLM P54132 1/20 0.46
FABP2 P12104 1/20 0.46
SLC22A12 Q96S37 1/20 0.46

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
SCHEMBL11738947 0.91 PPARG (0.72) PPARAPPARGMEN1CYP1A2CYP3A4
SCHEMBL4035957 0.87 PPARG (0.48) PPARAPPARGMEN1CYP1A2CYP3A4
SCHEMBL4036404 0.86 PPARG (0.66) PPARAPPARGMEN1CYP1A2CYP3A4
SCHEMBL4033331 0.86 PPARA (0.66) PPARAPPARGMEN1CYP1A2CYP3A4
SCHEMBL4036197 0.86 PPARG (0.66) PPARAPPARGMEN1CYP1A2CYP3A4
SCHEMBL3484590 0.85 PPARA (0.42) PPARAPPARGMEN1CYP1A2CYP3A4
SCHEMBL11537001 0.80 PPARA (0.81) PPARAPPARGMEN1CYP1A2CYP3A4
SCHEMBL4033120 0.80 MMP2 (0.49) PPARAPPARGMEN1CYP1A2CYP3A4
SCHEMBL4042833 0.78 PPARA (0.73) PPARAPPARGMEN1CYP1A2CYP3A4
SCHEMBL4036545 0.76 PPARG (0.60) PPARAPPARGMEN1CYP1A2CYP3A4

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