SCHEMBL7004566

SCHEMBL7004566

O=c1[nH]c(SCc2ccc(F)cc2)ncc1Cc1cnc(OCc2ccccc2)nc1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 14/20 0.67
DAO P14920 2/20 0.49
MAOB P27338 1/20 0.48
KDM6B O15054 1/20 0.47
KDM4A O75164 1/20 0.47
KDM4D Q6B0I6 1/20 0.47
HIF1AN Q9NWT6 1/20 0.47
KDM5B Q9UGL1 1/20 0.47
KDM2A Q9Y2K7 1/20 0.47
CTSB P07858 1/20 0.46
HTT P42858 1/20 0.44

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
SCHEMBL4423257 0.88 PLA2G7 (0.76) PLA2G7DAOMAOBKDM6BKDM4A
SCHEMBL7011666 0.86 PLA2G7 (0.71) PLA2G7DAOMAOBKDM6BKDM4A
SCHEMBL4423080 0.85 PLA2G7 (0.72) PLA2G7MAOB
SCHEMBL7585604 0.82 PLA2G7 (0.78) PLA2G7DAOMAOB
SCHEMBL7007074 0.81 PLA2G7 (0.87) PLA2G7DAOKDM6BKDM4AKDM4D
SCHEMBL4418525 0.80 PLA2G7 (1.00) PLA2G7DAOMAOB
SCHEMBL4419405 0.80 PLA2G7 (0.73) PLA2G7DAOMAOB
SCHEMBL4418872 0.79 PLA2G7 (0.72) PLA2G7DAOMAOB
SCHEMBL4415191 0.78 PLA2G7 (0.74) PLA2G7DAOMAOB
SCHEMBL7582759 0.78 PLA2G7 (0.71) PLA2G7DAOMAOB

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
EP-1028955-B1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM PLC (GB) 2003-07-16 EP claimed
US-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them HICKEY DEIRDRE MARY BERNADETTE (GB) 2002-08-29 US claimed
EP-1028955-A1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SmithKline Beecham p.l.c. (GB) 2000-08-23 EP claimed
WO-1999024420-A1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM PLC (GB) 1999-05-20 WO claimed
US-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them HICKEY DEIRDRE MARY BERNADETTE (GB) 2002-08-29 US disclosed
US-6417192-B1 DRUGS WITH PYRIMIDONE COMPOUNDS INHIBITORS OF THE ENZYME LDL PLA.SUB.2 AND THEREFORE OF USE IN TREATING ATHEROSCLEROSIS. SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-09 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 (1 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-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them PLA2G7, PLA2G1B, PLA2G4C PLA2G7 1/4885DAO 862/4885MAOB 486/4885

“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.