SCHEMBL14656133

SCHEMBL14656133

CN1CCCn2c1cc(OCCc1cc(F)c(Oc3ccc(F)c(F)c3)cn1)nc2=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 8/20 0.35
GPR84 Q9NQS5 6/20 0.33
ACHE P22303 1/20 0.32
CHRNA7 P36544 1/20 0.32
PDE4A P27815 1/20 0.32
CCNC P24863 2/20 0.31
CDK8 P49336 2/20 0.31

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
SCHEMBL14656278 0.85 GPR84 (0.39) PLA2G7GPR84
SCHEMBL14656369 0.83 PLA2G7 (0.36) PLA2G7GPR84
SCHEMBL14667798 0.83 PLA2G7 (0.37) PLA2G7GPR84
SCHEMBL14656263 0.81 PLA2G7 (0.52) PLA2G7GPR84
SCHEMBL14670172 0.81 PLA2G7 (0.45) PLA2G7GPR84PDE4A
SCHEMBL14656311 0.80 PLA2G7 (0.49) PLA2G7GPR84
SCHEMBL15814347 0.79 GPR84 (0.40) PLA2G7GPR84
SCHEMBL14656360 0.79 PLA2G7 (0.47) PLA2G7GPR84
SCHEMBL14656453 0.77 PLA2G7 (0.44) PLA2G7GPR84
SCHEMBL14656086 0.76 GPR84 (0.36) GPR84ACHECHRNA7PDE4A

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-9273054-B2 Substituted pyrimido[1,6-a]pyrimidines as Lp-PLA2 inhibitors GLAXO GROUP LIMITED (GB) 2016-03-01 US disclosed
US-20140179716-A1 BICYCLIC PYRIMIDONE COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-06-26 US disclosed
EP-2736908-A1 BICYCLIC PYRIMIDONE COMPOUNDS Glaxo Group Limited (GB) 2014-06-04 EP disclosed
US-20130030012-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-01-31 US disclosed
WO-2013014185-A1 BICYCLIC PYRIMIDONE COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-01-31 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 (2 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-20140179716-A1 BICYCLIC PYRIMIDONE COMPOUNDS PLA2G7, PLA2G4A, PLA2G1B PLA2G7 1/4885GPR84 911/4885ACHE 1085/4885
US-20130030012-A1 COMPOUNDS LPCAT1, PLA2G7, PLAAT2 PLA2G7 2/4885GPR84 847/4885ACHE 370/4885

“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.