SCHEMBL4034526

SCHEMBL4034526

COc1cc(-c2oc3cc(CCC(C)CCCC(C)C)ccc3c(=O)c2OCc2ccccc2)cc(OC)c1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.47
ABCG2 Q9UNQ0 11/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 2/20 0.40
CYP3A4 P08684 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 2/20 0.40
THRB P10828 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.39
ABCB1 P08183 2/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37

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
SCHEMBL4039231 0.97 PPARG (0.47) PPARGABCG2KDM4EALDH1A1MEN1
SCHEMBL4034328 0.90 PPARG (0.49) PPARGABCG2KDM4EALDH1A1MEN1
SCHEMBL4039498 0.84 PPARG (0.50) PPARGABCG2KDM4EALDH1A1MEN1
SCHEMBL4035989 0.84 PPARG (0.50) PPARGABCG2KDM4EALDH1A1MEN1
SCHEMBL3340894 0.84 PPARG (0.50) PPARGABCG2KDM4EALDH1A1MEN1
SCHEMBL4042000 0.83 PPARG (0.51) PPARGABCG2KDM4EALDH1A1MEN1
SCHEMBL4036191 0.81 PPARG (0.49) PPARGABCG2KDM4EALDH1A1MEN1
SCHEMBL13648968 0.81 PPARG (0.49) PPARGABCG2KDM4EALDH1A1MEN1
SCHEMBL4034678 0.81 PPARG (0.49) PPARGABCG2KDM4EALDH1A1MEN1
SCHEMBL3343972 0.80 PPARG (0.55) PPARGABCG2KDM4EALDH1A1MEN1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7601754-B2 Flavonoid compounds as therapeutic antioxidants ANTOXIS LIMITED (GB) 2009-10-13 US disclosed
US-7601754-B2 Flavonoid compounds as therapeutic antioxidants ANTOXIS LIMITED (GB) 2009-10-13 US disclosed
US-7601754-B2 Flavonoid compounds as therapeutic antioxidants ANTOXIS LIMITED (GB) 2009-10-13 US disclosed
EP-1534698-B1 FLAVONOID COMPOUNDS AS THERAPEUTIC ANTIOXIDANTS ROWETT RES INST (GB) 2007-09-19 EP disclosed
EP-1534698-B1 FLAVONOID COMPOUNDS AS THERAPEUTIC ANTIOXIDANTS ROWETT RES INST (GB) 2007-09-19 EP disclosed
US-20060137207-A1 Flavonoid compounds as therapeutic antioxidants ANTOXIS LIMITED (GB) 2006-06-29 US disclosed
EP-1534698-A1 FLAVONOID COMPOUNDS AS THERAPEUTIC ANTIOXIDANTS The Rowett Research Institute (GB) 2005-06-01 EP disclosed
WO-2004007475-A1 FLAVONOID COMPOUNDS AS THERAPEUTIC ANTIOXIDANTS ROWETT RESEARCH INSTITUTE (GB) 2004-01-22 WO disclosed