SCHEMBL9889588

SCHEMBL9889588

Cc1cc(Oc2ccc(CNc3nc(=O)c(Cc4cnn(C)c4)c[nH]3)cc2)ccc1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PLA2G7 Q13093 4/20 0.35
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34
KCNH2 Q12809 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
PDE1A P54750 1/20 0.34
PDE1B Q01064 1/20 0.34
PDE1C Q14123 1/20 0.34
PDE10A Q9Y233 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
JAK2 O60674 3/20 0.33
JAK1 P23458 3/20 0.33
JAK3 P52333 3/20 0.33
TYK2 P29597 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL9892556 0.89 PLA2G7 (0.44) PLA2G7
SCHEMBL9889585 0.86 PLA2G7 (0.41) PLA2G7HTR2ASLC6A4KCNH2MEN1
Trifluoroacetic Acid SCHEMBL9103211 0.85 KDR (0.43) PLA2G7
SCHEMBL9889595 0.83 PLA2G7 (0.42) PLA2G7
SCHEMBL9106542 0.82 PLA2G7 (0.41) PLA2G7MEN1KMT2AHSD17B10POLB
SCHEMBL9889586 0.82 PLA2G7 (0.36) PLA2G7
SCHEMBL15278097 0.82 CYP3A4 (0.36) PLA2G7LIPGPDE10AMEN1KMT2A
SCHEMBL9889654 0.82 PLA2G7 (0.37) PLA2G7MEN1KMT2AHSD17B10
SCHEMBL9107294 0.81 PLA2G7 (0.44) PLA2G7
SCHEMBL9889616 0.79 PLA2G7 (0.34) PLA2G7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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
US-20120142717-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-06-07 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 (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-20120142717-A1 COMPOUNDS LIPG, PLA2G1B, ENPP2 HPGD 602/4885SMN1; SMN2 3782/4885PLA2G7 6/4885
US-20130252963-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASE OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B HPGD 360/4885SMN1; SMN2 2828/4885PLA2G7 4/4885
US-20150099756-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B HPGD 335/4885SMN1; SMN2 2782/4885PLA2G7 4/4885

“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.