SCHEMBL4033755

SCHEMBL4033755

CC(C)(Oc1ccccc1Cc1ccc(CBr)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PPARG P37231 10/20 0.43
PPARA Q07869 5/20 0.43
MGLL Q99685 1/20 0.42
LMNA P02545 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
HRH1 P35367 3/20 0.40
PPARD Q03181 1/20 0.40
DRD2 P14416 1/20 0.39
DRD1 P21728 1/20 0.39
DRD3 P35462 1/20 0.39

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
SCHEMBL11566628 0.90 KDM4E (0.54) KDM4EALDH1A1HSD17B10PPARGPPARA
SCHEMBL11285273 0.86 PPARA (0.53) KDM4EALDH1A1HSD17B10PPARGPPARA
SCHEMBL3484028 0.84 FBP1 (0.47) PPARGPPARA
SCHEMBL4035654 0.81 PPARG (0.48) KDM4EALDH1A1HSD17B10PPARGPPARA
SCHEMBL4033438 0.80 KDM4E (0.53) KDM4EALDH1A1HSD17B10PPARGPPARA
SCHEMBL29224676 0.79 KDM4E (0.58) KDM4EALDH1A1HSD17B10PPARGPPARA
SCHEMBL4036197 0.78 PPARG (0.66) PPARGPPARAPPARD
SCHEMBL5795204 0.76 KDM4E (0.55) KDM4EALDH1A1HSD17B10PPARGPPARA
SCHEMBL5794671 0.76 KDM4E (0.55) KDM4EALDH1A1HSD17B10PPARGPPARA
SCHEMBL11738947 0.76 PPARG (0.72) PPARGPPARAPPARD

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