SCHEMBL311798

SCHEMBL311798

O=c1cc(-c2ccc(O)c(O)c2)[nH]c2cccc(O)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
KMT2A Q03164 3/20 0.51
HSD17B10 Q99714 2/20 0.51
MEN1 O00255 2/20 0.51
CYP3A4 P08684 2/20 0.51
MAPT P10636 2/20 0.51
MAPK1 P28482 2/20 0.51
ALOX5 P09917 1/20 0.51
CYP2C9 P11712 1/20 0.51
ALOX15 P16050 1/20 0.51
ALOX12 P18054 1/20 0.51
CYP2C19 P33261 1/20 0.51
RECQL P46063 1/20 0.51
IP6K2 Q9UHH9 1/20 0.51
POLH Q9Y253 1/20 0.51
CSNK1D P48730 1/20 0.42
APP P05067 2/20 0.42
HPGD P15428 4/20 0.41
LMNA P02545 2/20 0.41
CTSV O60911 3/20 0.41

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
SCHEMBL312037 0.86 HPGD (0.50) KDM4EKMT2AHSD17B10MEN1CYP3A4
SCHEMBL312542 0.80 CTSV (0.66) KDM4EKMT2AHSD17B10MEN1MAPT
SCHEMBL312439 0.78 RIPK1 (0.45) KDM4EKMT2AMEN1CSNK1DHPGD
SCHEMBL312608 0.76 MGAM (0.40) KMT2AMEN1CYP3A4MAPTMAPK1
SCHEMBL14690773 0.75 MEN1 (0.43) KDM4EKMT2AHSD17B10MEN1CYP3A4
Bromide SCHEMBL20496402 0.74 MEN1 (0.43) KDM4EKMT2AHSD17B10MEN1CYP3A4
SCHEMBL311336 0.73 TNKS (0.50) KDM4EKMT2AHSD17B10MEN1CYP3A4
SCHEMBL311903 0.72 CTSV (0.49) KDM4EKMT2AHSD17B10HPGDLMNA
SCHEMBL340806 0.71 ALDH1A1 (0.60) KDM4EKMT2AMEN1MAPTMAPK1
SCHEMBL311542 0.71 KMT2A (0.42) KDM4EKMT2AMEN1MAPK1HPGD

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-8242130-B2 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases RESVERLOGIX CORP. (CA) 2012-08-14 US disclosed
EP-1838296-B1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES RESVERLOGIX CORP (CA) 2012-08-08 EP disclosed
US-8093273-B2 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases RESVERLOGIX CORP. (CA) 2012-01-10 US disclosed
EP-2332527-A2 Flavanoids and Isoflavanoids for the prevention and treatment of cardiovascular diseases RESVERLOGIX CORP. (CA) 2011-06-15 EP disclosed
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES RESVERLOGIX CORP. (CA) 2009-10-15 US disclosed
US-20060205767-A1 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases HEPALINK (HONG KONG) LIMITED (HK) 2006-09-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060205767-A1 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases APOB, APOL1, FABP3 KDM4E 3504/4885KMT2A 2842/4885HSD17B10 327/4885
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, APOL1, FABP3 KDM4E 3504/4885KMT2A 2842/4885HSD17B10 327/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.