SCHEMBL312833

SCHEMBL312833

O=c1cc(-c2ncc(O)cc2O)oc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.62
KDM4E B2RXH2 5/20 0.62
CYP3A4 P08684 5/20 0.62
MEN1 O00255 4/20 0.62
KMT2A Q03164 4/20 0.62
CYP2C9 P11712 3/20 0.62
CYP2C19 P33261 3/20 0.62
TNKS O95271 8/20 0.58
SMN1; SMN2 Q16637 5/20 0.58
PARP1 P09874 5/20 0.58
TNKS2 Q9H2K2 5/20 0.58
MAPT P10636 3/20 0.58
ALOX15 P16050 3/20 0.58
FTO Q9C0B1 2/20 0.58
HSD17B10 Q99714 2/20 0.58
MAPK1 P28482 2/20 0.58
ALDH1A1 P00352 2/20 0.58
ALOX5 P09917 1/20 0.58
ST6GAL1 P15907 1/20 0.58
DHODH Q02127 1/20 0.58

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
SCHEMBL755547 0.79 KMT2A (0.53) HPGDKDM4ECYP3A4MEN1KMT2A
SCHEMBL312714 0.79 TNKS (0.62) HPGDKDM4ECYP3A4MEN1KMT2A
SCHEMBL4650047 0.77 HPGD (1.00) HPGDKDM4ECYP3A4MEN1KMT2A
SCHEMBL312875 0.75 KDM4E (0.58) HPGDKDM4ECYP3A4MEN1KMT2A
Flavone SCHEMBL27987776 0.75 TNKS (0.84) HPGDKDM4ECYP3A4MEN1KMT2A
SCHEMBL345706 0.74 TNKS (1.00) HPGDKDM4ECYP3A4MEN1KMT2A
SCHEMBL29664745 0.74 TNKS (1.00) HPGDKDM4ECYP3A4MEN1KMT2A
SCHEMBL311199 0.73 TNKS (0.67) HPGDKDM4ECYP3A4MEN1KMT2A
SCHEMBL127446 0.73 TNKS (1.00) HPGDKDM4ECYP3A4MEN1KMT2A
SCHEMBL312255 0.73 AKR1C3 (1.00) HPGDKDM4ECYP3A4MEN1KMT2A

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 HPGD 138/4885KDM4E 3504/4885CYP3A4 1730/4885
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, APOL1, FABP3 HPGD 138/4885KDM4E 3504/4885CYP3A4 1730/4885

“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.