SCHEMBL312031

SCHEMBL312031

O=c1cc(-c2ccc(O)cc2)[nH]c2c(O)c(O)ccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 3/20 0.49
SRC P12931 1/20 0.42
PRKACA P17612 1/20 0.42
PRKACG P22612 1/20 0.42
PRKACB P22694 1/20 0.42
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
XDH P47989 1/20 0.39
PFKFB3 Q16875 1/20 0.39
BRD4 O60885 1/20 0.39
CDC7 O00311 1/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MPO P05164 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL1848418 0.88 CTSV (0.52) SRCPRKACAPRKACGPRKACBADORA2A
SCHEMBL1849234 0.88 HPGD (0.53) TERTADORA2AKDM4EALDH1A1HPGD
Bromide SCHEMBL1976213 0.87 CTSV (0.51) SRCPRKACAPRKACGPRKACBADORA2A
Bromide SCHEMBL1978677 0.86 HPGD (0.51) TERTADORA2AKDM4EALDH1A1HPGD
SCHEMBL12588956 0.84 ALDH1A1 (0.57) KDM4EALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL12588953 0.84 QPCT (0.43) SRCPRKACAPRKACGPRKACBADORA2A
SCHEMBL312027 0.81 KDM4E (0.55) KDM4EHPGDKMT2AHSD17B10LMNA
SCHEMBL311330 0.79 KMT2A (0.43) ADORA2AADORA2BCDC7KDM4EALDH1A1
SCHEMBL312155 0.78 KMT2A (0.42) ADORA2AADORA2BXDHPFKFB3CDC7
SCHEMBL313968 0.76 CTSV (0.49) KDM4EALDH1A1HPGDKMT2AHSD17B10

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 TERT 3484/4885SRC 3298/4885PRKACA 4623/4885
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, APOL1, FABP3 TERT 3484/4885SRC 3298/4885PRKACA 4623/4885

“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.