SCHEMBL4034217

SCHEMBL4034217

CCCCCCCCc1cc2c(=O)c(O)c(-c3cc(OC)c(OCc4ccccc4)c(OC)c3)oc2cc1CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.46
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
ALOX5 P09917 13/20 0.45
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
FPR1 P21462 2/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
CYP3A4 P08684 1/20 0.43
HPGD P15428 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PPARG P37231 1/20 0.43
ABCB1 P08183 1/20 0.43

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
SCHEMBL13654313 0.89 ALOX5 (0.51) TP53MAPTPOLBRXFP1ALOX5
SCHEMBL4037848 0.89 MAPT (0.52) TP53MAPTPOLBRXFP1ALOX5
SCHEMBL4035682 0.86 MAPT (0.49) TP53MAPTPOLBRXFP1KDM4E
SCHEMBL4039498 0.80 PPARG (0.50) MAPTALOX5CNR1CNR2KDM4E
SCHEMBL4035989 0.80 PPARG (0.50) MAPTALOX5CNR1CNR2KDM4E
SCHEMBL3340894 0.80 PPARG (0.50) MAPTALOX5CNR1CNR2KDM4E
SCHEMBL3339178 0.79 ABCB1 (0.53) TP53MAPTPOLBRXFP1KDM4E
SCHEMBL4036073 0.79 MAPT (0.57) TP53MAPTPOLBRXFP1KDM4E
SCHEMBL13654299 0.78 MAPT (0.56) TP53MAPTPOLBRXFP1ALOX5
SCHEMBL4034130 0.78 MEN1 (0.50) TP53MAPTPOLBALOX5CNR1

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 6 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
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