SCHEMBL8664419

SCHEMBL8664419

COC(=O)C=Cc1ccc(OC)nc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.58
NPC1 O15118 5/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
LMNA P02545 4/20 0.56
RAB9A P51151 4/20 0.56
MAPT P10636 4/20 0.56
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
TYR P14679 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
CA14 Q9ULX7 1/20 0.56
KMT2A Q03164 4/20 0.54
KDM4E B2RXH2 3/20 0.54
GAA P10253 2/20 0.52
POLB P06746 1/20 0.52
TTR P02766 1/20 0.51
APP P05067 1/20 0.51
TUBB4A P04350 1/20 0.51

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
SCHEMBL8664417 1.00 FDPS (0.58) FDPSNPC1SMN1; SMN2LMNARAB9A
SCHEMBL28609817 0.89 GSK3B (0.60) NPC1SMN1; SMN2LMNARAB9AMAPT
SCHEMBL1843115 0.88 MKNK1 (0.55) FDPSNPC1SMN1; SMN2LMNARAB9A
SCHEMBL28608967 0.87 F3 (0.56) NPC1SMN1; SMN2LMNARAB9AMAPT
SCHEMBL3870743 0.86 FDPS (0.61) FDPSNPC1SMN1; SMN2LMNARAB9A
SCHEMBL30018286 0.86 FDPS (0.61) FDPSNPC1SMN1; SMN2LMNARAB9A
SCHEMBL29860630 0.86 FDPS (0.61) FDPSNPC1SMN1; SMN2LMNARAB9A
SCHEMBL20153362 0.86 FDPS (0.61) FDPSNPC1SMN1; SMN2LMNARAB9A
SCHEMBL3870746 0.86 FDPS (0.61) FDPSNPC1SMN1; SMN2LMNARAB9A
SCHEMBL1124609 0.85 P4HTM (0.58) NPC1SMN1; SMN2LMNARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2649053-B1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 GLAXO GROUP LTD (GB) 2015-11-04 EP disclosed
US-9174968-B2 Pyrimidinone compounds for use in the treatment of diseases or conditions mediated by LP-PLA2 GLAXO GROUP LIMITED (GB) 2015-11-03 US disclosed
US-20150099756-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 GLAXO GROUP LIMITED (GB) 2015-04-09 US disclosed
US-20140113922-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-04-24 US disclosed
US-8637536-B2 Pyrimidinone compounds for use in the treatment of diseases or conditions mediated by Lp-PLA2 GLAXO GROUP LIMITED (GB) 2014-01-28 US disclosed
EP-2649053-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP - PLA2 Glaxo Group Limited (GB) 2013-10-16 EP disclosed
US-20130252963-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASE OR CONDITIONS MEDIATED BY LP-PLA2 GLAXO GROUP LIMITED (GB) 2013-09-26 US disclosed
WO-2012076435-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP - PLA2 GLAXO GROUP LIMITED (GB) 2012-06-14 WO disclosed
US-20120142717-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-06-07 US disclosed
US-5763461-A ANTIPICORNAVIRAL AGENTS SANOFI (FR) 1998-06-09 US disclosed
US-5618821-A VIRICIDES, PICORNAVIRUS SANOFI, S.A. (FR) 1997-04-08 US disclosed
WO-1995031438-A1 THERAPEUTIC PHENOXYALKYLHETEROCYCLES SANOFI WINTHROP, INC. (US) 1995-11-23 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 (4 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-20140113922-A1 COMPOUNDS LIPG, PLA2G1B, ENPP2 FDPS 605/4885NPC1 516/4885SMN1; SMN2 3782/4885
US-20120142717-A1 COMPOUNDS LIPG, PLA2G1B, ENPP2 FDPS 605/4885NPC1 516/4885SMN1; SMN2 3782/4885
US-20130252963-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASE OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B FDPS 443/4885NPC1 1408/4885SMN1; SMN2 2828/4885
US-20150099756-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B FDPS 434/4885NPC1 1383/4885SMN1; SMN2 2782/4885

“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.