SCHEMBL4034130

SCHEMBL4034130

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
RECQL P46063 3/20 0.50
KMT2A Q03164 3/20 0.50
CD38 P28907 2/20 0.50
ABCC1 P33527 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
ABCB1 P08183 1/20 0.47
MAPK8 P45983 2/20 0.44
KDM4E B2RXH2 2/20 0.42
SLCO2B1 O94956 2/20 0.42
ALDH1A1 P00352 2/20 0.42
APP P05067 2/20 0.42
BCHE P06276 2/20 0.42
CYP3A4 P08684 2/20 0.42
AMY1A P0DUB6 2/20 0.42
MAPT P10636 2/20 0.42
CYP2C9 P11712 2/20 0.42
PKM P14618 2/20 0.42
HPGD P15428 2/20 0.42
ALOX15 P16050 2/20 0.42

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
SCHEMBL2603356 0.89 MEN1 (0.48) MEN1RECQLKMT2ACD38ABCC1
SCHEMBL13654313 0.82 ALOX5 (0.51) MAPTACHEPOLBBACE1TP53
SCHEMBL12672400 0.81 MEN1 (0.46) MEN1RECQLKMT2ACD38ABCC1
SCHEMBL12639915 0.81 MEN1 (0.60) MEN1RECQLKMT2ACD38ABCC1
SCHEMBL13648970 0.81 MEN1 (0.60) MEN1RECQLKMT2ACD38ABCC1
SCHEMBL4035228 0.81 ABCB1 (0.58) MEN1RECQLKMT2ACD38ABCC1
SCHEMBL4043879 0.81 MEN1 (0.60) MEN1RECQLKMT2ACD38ABCC1
SCHEMBL4043863 0.81 MEN1 (0.60) MEN1RECQLKMT2ACD38ABCC1
SCHEMBL4034075 0.81 MEN1 (0.60) MEN1RECQLKMT2ACD38ABCC1
SCHEMBL582170 0.81 MEN1 (0.60) MEN1RECQLKMT2ACD38ABCC1

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
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