SCHEMBL4037848

SCHEMBL4037848

CCCCCCCCCCc1ccc2oc(-c3cc(OC)c(OCc4ccccc4)c(OC)c3)c(O)c(=O)c2c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.52
TP53 P04637 3/20 0.52
RXFP1 Q9HBX9 2/20 0.52
POLB P06746 1/20 0.52
ABCB1 P08183 1/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 2/20 0.46
CYP3A4 P08684 2/20 0.46
CASP1 P29466 2/20 0.46
CASP7 P55210 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ALOX5 P09917 13/20 0.45
PPARG P37231 1/20 0.44

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
SCHEMBL13654299 0.90 MAPT (0.56) MAPTTP53RXFP1POLBABCB1
SCHEMBL4034217 0.89 TP53 (0.46) MAPTTP53RXFP1POLBABCB1
SCHEMBL4035989 0.85 PPARG (0.50) MAPTKDM4EMEN1ALDH1A1CYP3A4
SCHEMBL4039498 0.85 PPARG (0.50) MAPTKDM4EMEN1ALDH1A1CYP3A4
SCHEMBL3340894 0.85 PPARG (0.50) MAPTKDM4EMEN1ALDH1A1CYP3A4
SCHEMBL4036073 0.83 MAPT (0.57) MAPTTP53RXFP1POLBABCB1
SCHEMBL4036191 0.82 PPARG (0.49) MAPTKDM4EMEN1ALDH1A1CYP3A4
SCHEMBL13648968 0.82 PPARG (0.49) MAPTKDM4EMEN1ALDH1A1CYP3A4
SCHEMBL4034678 0.82 PPARG (0.49) MAPTKDM4EMEN1ALDH1A1CYP3A4
SCHEMBL4035682 0.79 MAPT (0.49) MAPTTP53RXFP1POLBABCB1

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