SCHEMBL9904786

SCHEMBL9904786

O=c1nc(OCCc2ccc(Cc3ccc(Cl)c(C(F)(F)F)c3)cc2)c(Cl)c[nH]1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 2/20 0.43
GPR84 Q9NQS5 1/20 0.39
IDO1 P14902 2/20 0.39
KDM4A O75164 1/20 0.38
KDM5A P29375 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
MCHR1 Q99705 1/20 0.36
MAOB P27338 1/20 0.35
RAF1 P04049 1/20 0.35
BRAF P15056 1/20 0.35
P2RX7 Q99572 3/20 0.34
AURKA O14965 1/20 0.34
RPS6KB1 P23443 1/20 0.34
AURKB Q96GD4 1/20 0.34
KCNN4 O15554 3/20 0.34
ROCK2 O75116 1/20 0.34
ROCK1 Q13464 1/20 0.34
DAO P14920 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
SCHEMBL9905003 0.92 PLA2G7 (0.42) PLA2G7GPR84IDO1KDM4AKDM5A
SCHEMBL9905004 0.88 PLA2G7 (0.54) PLA2G7GPR84RAF1BRAF
SCHEMBL15262591 0.80 DAO (0.41) GPR84MAOBDAO
SCHEMBL9904954 0.80 IDO1 (0.42) PLA2G7GPR84IDO1KDM4AKDM5A
SCHEMBL9900883 0.80 PLA2G7 (0.53) PLA2G7GPR84RAF1BRAF
SCHEMBL9904927 0.79 PLA2G7 (0.52) PLA2G7GPR84RAF1BRAF
SCHEMBL15277239 0.78 IDO1 (0.40) PLA2G7GPR84IDO1KDM4AKDM5A
SCHEMBL15262208 0.76 IDO1 (0.40) PLA2G7GPR84IDO1KDM4AKDM5A
SCHEMBL9923464 0.74 PLA2G7 (0.39) PLA2G7GPR84IDO1KDM4AKDM5A
SCHEMBL15261625 0.74 PLA2G7 (0.46) PLA2G7GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859573-B2 Pyrimidinone and pyridinone compounds for use in the treatment of diseases or conditions mediated by Lp-PLA2 GLAXO GROUP LIMITED (GB) 2014-10-14 US disclosed
EP-2649050-A1 COMPOUNDS Glaxo Group Limited (GB) 2013-10-16 EP disclosed
US-20130252986-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-09-26 US disclosed
WO-2012075917-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-06-14 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-20130252986-A1 COMPOUNDS LIPG, ENPP2, PLA2G1B PLA2G7 6/4885GPR84 773/4885IDO1 2470/4885

“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.