SCHEMBL4865013

SCHEMBL4865013

Nc1cccnc1N1CCSCC1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.54
GRIN3B O60391 1/20 0.54
GRIN1 Q05586 1/20 0.54
GRIN2A Q12879 1/20 0.54
GRIN2B Q13224 1/20 0.54
GRIN2C Q14957 1/20 0.54
GRIN3A Q8TCU5 1/20 0.54
LGMN Q99538 1/20 0.42
PIK3CA P42336 1/20 0.41
MALT1 Q9UDY8 3/20 0.39
GAA P10253 1/20 0.38
HIF1A Q16665 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HSD11B1 P28845 1/20 0.38
PARP1 P09874 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
SCHEMBL29508931 0.83 GRIN2D (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4867515 0.83 GRIN2D (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4437674 0.81 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL27517144 0.81 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29509151 0.81 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL14335129 0.80 GRIN2D (0.55) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8415184 0.79 EPHX2 (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29445436 0.79 CYP1A2 (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL14782171 0.79 GRIN2D (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10094620 0.79 HSD11B1 (0.51) PIK3CAKDM4EHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7361662-B2 Pyridopyrimidinone compounds, method for production thereof and medicaments comprising the same LES LABORATOIRES SERVIER (FR) 2008-04-22 US disclosed
CN-1330650-C Pyridopyrimidinone compounds, process for their preparation and medicaments containing them SERVIER LAB (FR) 2007-08-08 CN disclosed
EP-1560826-B1 PYRIDOPYRIMIDINONE COMPOUNDS, METHOD FOR PRODUCTION THEREOF AND MEDICAMENTS COMPRISING THE SAME SERVIER LAB (FR) 2006-04-12 EP disclosed
US-20050288311-A1 Pyridopyrimidinone compounds, method for production thereof and medicaments comprising the same LES LABORATOIERS SERVIER (FR) 2005-12-29 US disclosed
CN-1711260-A Pyridopyrimidinone compounds, process for their preparation and medicaments containing them SERVIER LAB (FR) 2005-12-21 CN disclosed
EP-1560826-A1 PYRIDOPYRIMIDINONE COMPOUNDS, METHOD FOR PRODUCTION THEREOF AND MEDICAMENTS COMPRISING THE SAME Les Laboratoires Servier (FR) 2005-08-10 EP disclosed
WO-2004043956-A1 PYRIDOPYRIMIDINONE COMPOUNDS, METHOD FOR PRODUCTION THEREOF AND MEDICAMENTS COMPRISING THE SAME LES LABORATOIRES SERVIER (FR) 2004-05-27 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 (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-20050288311-A1 Pyridopyrimidinone compounds, method for production thereof and medicaments comprising the same MAP4K2, PLK2, MAP4K3 GRIN2D 1759/4885GRIN3B 1675/4885GRIN1 1201/4885

“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.