SCHEMBL4420138

SCHEMBL4420138

Cn1cc(Cc2cn(CC(=O)OC(C)(C)C)c(SCc3ccc(F)cc3)nc2=O)cn1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 20/20 0.68
CYP3A4 P08684 1/20 0.61

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
SCHEMBL4411608 0.92 PLA2G7 (0.57) PLA2G7CYP3A4
SCHEMBL4425737 0.91 PLA2G7 (0.59) PLA2G7CYP3A4
SCHEMBL4415976 0.89 PLA2G7 (0.57) PLA2G7CYP3A4
SCHEMBL7601075 0.89 PLA2G7 (0.53) PLA2G7CYP3A4
SCHEMBL4419222 0.88 PLA2G7 (0.57) PLA2G7
SCHEMBL4552007 0.87 PLA2G7 (0.74) PLA2G7CYP3A4
SCHEMBL4412340 0.87 PLA2G7 (0.51) PLA2G7CYP3A4
SCHEMBL4416174 0.87 PLA2G7 (0.59) PLA2G7
SCHEMBL4385379 0.86 PLA2G7 (0.59) PLA2G7CYP3A4
SCHEMBL3538336 0.85 PLA2G7 (0.58) PLA2G7CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1479671-B1 Pyrimidinone compounds SMITHKLINE BEECHAM PLC (GB) 2009-05-27 EP disclosed
CN-1286822-C Pyrimidinone compounds SMITHKLINE BEECHAM PLC (GB) 2006-11-29 CN disclosed
US-7115616-B2 Pyrimidinone compounds SMITHKLINE BEECHAM PLC (GB) 2006-10-03 US disclosed
US-6953803-B1 1-[(N-(2-(diethylamino)ethyl)-N-(4-(4-trifluoromethylphenyl)benzyl)aminocarbonylmethyl)]-2-(4-fluorobenzyl)thio-5-(1-methyl-4-pyrazolylmethyl)pyrimidin-4-one; enzyme inhibitors of lipoprotein associated phospholipase A2 (Lp-PLA2); atherosclerosis SMITHKLINE BEECHAM P.L.C. (GB) 2005-10-11 US disclosed
EP-1175408-B1 PYRIMIDINONE COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 2004-12-01 EP disclosed
EP-1479671-A1 Pyrimidinone compounds SMITHKLINE BEECHAM PLC (GB) 2004-11-24 EP disclosed
US-20040167142-A1 Pyrimidinone compounds SMITHKLINE BEECHAM P.L.C. 2004-08-26 US disclosed
CN-1358175-A Pyrimidinone compounds SMITHKLINE BEECHAM PLC (GB) 2002-07-10 CN disclosed
EP-1175408-A1 PYRIMIDINONE COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 2002-01-30 EP disclosed
WO-2000066567-A1 PYRIMIDINONE COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 2000-11-09 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 (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-20040167142-A1 Pyrimidinone compounds LPL, LIPG, PCSK9 PLA2G7 43/4885CYP3A4 1555/4885

“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.