SCHEMBL311280

SCHEMBL311280

O=c1cc(-c2ccc(O)cn2)oc2cc(O)ccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.61
▸ CYP3A4 P08684 4/20 0.61
▸ QPCT Q16769 3/20 0.61
▸ ALDH1A1 P00352 3/20 0.61
▸ CYP19A1 P11511 2/20 0.61
▸ MAOA P21397 2/20 0.61
▸ MAOB P27338 2/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ KDM4E B2RXH2 2/20 0.61
▸ HSD17B10 Q99714 2/20 0.61
▸ MPO P05164 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ IP6K2 Q9UHH9 1/20 0.61
▸ AKR1B1 P15121 2/20 0.58
▸ CA12 O43570 1/20 0.58
▸ AKR1B10 O60218 1/20 0.58
▸ CA1 P00915 1/20 0.58
▸ CA2 P00918 1/20 0.58
▸ CYP1A2 P05177 1/20 0.58
▸ ABCB1 P08183 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
SCHEMBL311667 0.88 CYP3A4 (0.61) HPGDCYP3A4QPCTALDH1A1CYP19A1
SCHEMBL312714 0.87 TNKS (0.62) HPGDCYP3A4ALDH1A1CYP19A1MAOA
SCHEMBL24046861 0.86 KDM4E (0.69) HPGDCYP3A4ALDH1A1CYP19A1MAOB
SCHEMBL311730 0.77 CYP3A4 (0.71) HPGDCYP3A4QPCTALDH1A1CYP19A1
SCHEMBL312653 0.77 AR (0.63) HPGDCYP3A4ALDH1A1SMN1; SMN2KDM4E
SCHEMBL157723 0.76 CYP3A4 (1.00) HPGDCYP3A4QPCTALDH1A1CYP19A1
SCHEMBL31167385 0.76 CYP3A4 (1.00) HPGDCYP3A4QPCTALDH1A1CYP19A1
SCHEMBL311288 0.76 LOXL2 (0.47) HPGDCYP3A4ALDH1A1CYP19A1MAOA
SCHEMBL6832163 0.75 HPGD (0.80) HPGDCYP3A4QPCTALDH1A1CYP19A1
SCHEMBL12829685 0.75 CYP3A4 (0.79) HPGDCYP3A4QPCTALDH1A1CYP19A1

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 138/4885CYP3A4 1730/4885QPCT 2445/4885
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, APOL1, FABP3 HPGD 138/4885CYP3A4 1730/4885QPCT 2445/4885

“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.

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