SCHEMBL4035228

SCHEMBL4035228

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.58
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
RECQL P46063 3/20 0.50
CD38 P28907 2/20 0.50
ABCC1 P33527 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
MAPK8 P45983 1/20 0.47
MAPT P10636 7/20 0.46
KDM4E B2RXH2 4/20 0.46
CYP3A4 P08684 3/20 0.46
CYP2C9 P11712 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TP53 P04637 4/20 0.45
RXFP1 Q9HBX9 2/20 0.45
CSNK2A2 P19784 4/20 0.44
CSNK2B P67870 4/20 0.44
CSNK2A1 P68400 4/20 0.44
CYP1A2 P05177 2/20 0.43
CYP2D6 P10635 2/20 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
SCHEMBL13648970 0.91 MEN1 (0.60) ABCB1MEN1KMT2ARECQLCD38
SCHEMBL4044129 0.91 MEN1 (0.60) ABCB1MEN1KMT2ARECQLCD38
SCHEMBL4043863 0.91 MEN1 (0.60) ABCB1MEN1KMT2ARECQLCD38
SCHEMBL4034075 0.91 MEN1 (0.60) ABCB1MEN1KMT2ARECQLCD38
SCHEMBL4043879 0.91 MEN1 (0.60) ABCB1MEN1KMT2ARECQLCD38
SCHEMBL12639915 0.91 MEN1 (0.60) ABCB1MEN1KMT2ARECQLCD38
SCHEMBL582170 0.91 MEN1 (0.60) ABCB1MEN1KMT2ARECQLCD38
SCHEMBL12557473 0.87 ABCB1 (0.57) ABCB1MEN1KMT2ARECQLMAPT
SCHEMBL4034126 0.86 MEN1 (0.62) ABCB1MEN1KMT2ARECQLCD38
SCHEMBL13654299 0.82 MAPT (0.56) ABCB1MEN1KMT2AMAPTKDM4E

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