SCHEMBL326091

SCHEMBL326091

CCOC(=O)Nc1cc(O)ccc1-c1cc(=O)c2c(O)nccc2o1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 5/20 0.42
POLH Q9Y253 1/20 0.41
MAOB P27338 1/20 0.40
TYR P14679 1/20 0.40
PTPN1 P18031 1/20 0.40
PTGS1 P23219 1/20 0.40
BACE1 P56817 1/20 0.40
PTPN12 Q05209 1/20 0.40
PTPN22 Q9Y2R2 1/20 0.40
EGFR P00533 1/20 0.39
RET P07949 1/20 0.39
KDR P35968 1/20 0.39
XDH P47989 1/20 0.39
KDM4E B2RXH2 3/20 0.38
HPGD P15428 3/20 0.38
HSD17B10 Q99714 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38

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
SCHEMBL312020 0.85 HPGD (0.40) ABL1MAOBKDM4EHPGDHSD17B10
SCHEMBL312849 0.85 MAOB (0.38) ABL1POLHMAOBTYRPTPN1
SCHEMBL311136 0.85 ABL1 (0.40) ABL1POLHMAOBTYRPTPN1
SCHEMBL312477 0.84 BACE1 (0.61) ABL1POLHMAOBTYRPTPN1
SCHEMBL313004 0.84 ATM (0.52) ABL1POLHMAOBTYRPTPN1
SCHEMBL312050 0.84 KDM4E (0.44) POLHMAOBTYRPTPN1PTGS1
SCHEMBL311135 0.83 MAOB (0.44) ABL1POLHMAOBEGFRRET
SCHEMBL312060 0.83 HPGD (0.44) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL312748 0.83 TYR (0.44) ABL1POLHMAOBTYRPTPN1
SCHEMBL311791 0.82 HPGD (0.51) MAOBKDM4EHPGDHSD17B10ALDH1A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130281396-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION RVX THERAPEUTICS INC. (CA) 2013-10-24 US disclosed
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
EP-1838296-A2 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES RESVERLOGIX CORP. (CA) 2007-10-03 EP 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
WO-2006045096-A2 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES RESVERLOGIX CORP. (CA) 2006-04-27 WO 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 (3 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 ABL1 3371/4885POLH 4318/4885MAOB 385/4885
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, APOL1, FABP3 ABL1 3371/4885POLH 4318/4885MAOB 385/4885
US-20130281396-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION BCOR, BMI1, PHKB ABL1 1286/4885POLH 1860/4885MAOB 4705/4885

“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.