Ellagic Acid

Ellagic Acid

SCHEMBL9146254

O=c1oc2c(O)c(O)cc3c(=O)oc4c(O)c(O)cc1c4c23.[AlH3]

nearest known ligand 0.96

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.96
MAPT P10636 4/20 0.96
HPGD P15428 3/20 0.96
BLM P54132 3/20 0.96
APEX1 P27695 3/20 0.96
RECQL P46063 3/20 0.96
TDP1 Q9NUW8 3/20 0.96
POLB P06746 3/20 0.96
GAA P10253 3/20 0.96
MEN1 O00255 2/20 0.96
KMT2A Q03164 2/20 0.96
PKLR P30613 2/20 0.96
GALNT2 Q10471 2/20 0.96
CA12 O43570 2/20 0.96
CA1 P00915 2/20 0.96
CA7 P43166 2/20 0.96
CA9 Q16790 2/20 0.96
CA13 Q8N1Q1 2/20 0.96
LMNA P02545 2/20 0.96
MAPK1 P28482 2/20 0.96

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
Ellagic Acid SCHEMBL29439360 0.98 KDM4E (1.00) KDM4EMAPTHPGDBLMAPEX1
Ellagic Acid SCHEMBL1645767 0.98 KDM4E (1.00) KDM4EMAPTHPGDBLMAPEX1
Ellagic Acid SCHEMBL20429 0.98 KDM4E (1.00) KDM4EMAPTHPGDBLMAPEX1
Ellagic Acid SCHEMBL30475160 0.98 KDM4E (1.00) KDM4EMAPTHPGDBLMAPEX1
Ellagic Acid SCHEMBL2639621 0.96 KDM4E (0.96) KDM4EMAPTHPGDBLMAPEX1
Ellagic Acid SCHEMBL8686551 0.96 KDM4E (0.96) KDM4EMAPTHPGDBLMAPEX1
Ellagic Acid SCHEMBL8686557 0.96 KDM4E (0.96) KDM4EMAPTHPGDBLMAPEX1
Ellagic Acid SCHEMBL21590140 0.96 KDM4E (0.96) KDM4EMAPTHPGDBLMAPEX1
Ellagic Acid SCHEMBL177722 0.96 KDM4E (0.96) KDM4EMAPTHPGDBLMAPEX1
Ellagic Acid SCHEMBL8686700 0.96 KDM4E (0.96) KDM4EMAPTHPGDBLMAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5413786-A Method of accelerating blood coagulation using a metal complex of oxidized ellagic acid SEKISUI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1995-05-09 US disclosed
US-5041558-A Iron Complex of Oxidized Ellagic Acid SEKISUI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-08-20 US disclosed