SCHEMBL312015

SCHEMBL312015

O=c1cc(-c2ccc(O)cc2)[nH]c2cc(F)cc(F)c12

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
KDM4E B2RXH2 4/20 0.46
CTSV O60911 1/20 0.46
CTSL P07711 1/20 0.46
HPGD P15428 5/20 0.44
LMNA P02545 4/20 0.44
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
IMPDH2 P12268 1/20 0.38
CDC7 O00311 1/20 0.38
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL311903 0.82 CTSV (0.49) KMT2AKDM4ECTSVCTSLHPGD
SCHEMBL313992 0.79 SMN1; SMN2 (0.43) MEN1KMT2AKDM4ECTSVCTSL
SCHEMBL311823 0.78 KDM4E (0.74) MEN1KMT2AKDM4ECTSVCTSL
SCHEMBL311728 0.77 ESR1 (0.49) MEN1KMT2AKDM4ECTSVCTSL
SCHEMBL311827 0.76 ADORA2A (0.39) MEN1KMT2AKDM4ECTSVCTSL
SCHEMBL312025 0.76 KDM4E (0.51) MEN1KMT2AKDM4ECTSVCTSL
SCHEMBL312265 0.75 SMN1; SMN2 (0.74) MEN1KMT2AKDM4ECTSVCTSL
SCHEMBL9007845 0.73 DAO (0.51) KDM4E
SCHEMBL311542 0.73 KMT2A (0.42) MEN1KMT2AKDM4EHPGDLMNA
SCHEMBL312037 0.73 HPGD (0.50) MEN1KMT2AKDM4ECTSVCTSL

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 MEN1 4653/4885KMT2A 2842/4885KDM4E 3504/4885
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, APOL1, FABP3 MEN1 4653/4885KMT2A 2842/4885KDM4E 3504/4885

“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.