SCHEMBL16623680

SCHEMBL16623680

CCc1cn(C)c(OCCc2cccc(Oc3ccc(C)c(Cl)c3)c2)nc1=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.36
NPBWR1 P48145 1/20 0.35
GRM2 Q14416 1/20 0.35
DHFR P00374 1/20 0.35
ALDH1A1 P00352 1/20 0.34
P2RX7 Q99572 1/20 0.34
MAOB P27338 1/20 0.34
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
CDK8 P49336 1/20 0.33
LMNA P02545 1/20 0.33
FAAH O00519 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
SCHEMBL16623945 0.87 PLA2G7 (0.36) GPR84NPBWR1GRM2DHFR
SCHEMBL9107505 0.83 GPR84 (0.39) GPR84ALDH1A1P2RX7
SCHEMBL9889691 0.78 P2RX7 (0.38) GPR84P2RX7
SCHEMBL9889692 0.78 PLA2G7 (0.42) GPR84P2RX7
SCHEMBL9889682 0.77 CYP3A4 (0.34) GPR84NPBWR1ALDH1A1P2RX7
SCHEMBL9104746 0.77 PLA2G7 (0.51) GPR84
SCHEMBL9889675 0.75 MAOA (0.33) GRM2ALDH1A1MAOB
SCHEMBL9889674 0.74 P2RX3 (0.39)
SCHEMBL9889577 0.73 PLA2G7 (0.49) GPR84
SCHEMBL9107928 0.73 PLA2G7 (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20150099756-A1 PYRIMIDINONE COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES OR CONDITIONS MEDIATED BY LP-PLA2 PLA2G1B, PLA2G4A, PLA2G4B GPR84 403/4885NPBWR1 1676/4885GRM2 1588/4885

“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.