SCHEMBL9900773

SCHEMBL9900773

O=c1cc(OCCc2ccc(Oc3ccc(Cl)c(C(F)(F)F)c3)cc2)cc[nH]1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 5/20 0.55
GPR84 Q9NQS5 2/20 0.52
CDK8 P49336 2/20 0.41
BRAF P15056 2/20 0.41
RAF1 P04049 1/20 0.41
PPARG P37231 4/20 0.39
PPARA Q07869 3/20 0.39
NSD2 O96028 1/20 0.39
ABL1 P00519 1/20 0.39
RIN1 Q13671 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
P2RX3 P56373 2/20 0.38
PTGES O14684 1/20 0.37
ALOX5 P09917 1/20 0.37
IDO1 P14902 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
SCHEMBL9901086 0.89 PPARG (0.52) PLA2G7GPR84CDK8PPARGPPARA
SCHEMBL15277230 0.83 GPR84 (0.49) GPR84PPARGNSD2ABL1RIN1
SCHEMBL9900892 0.82 PLA2G7 (0.54) PLA2G7GPR84CDK8BRAFRAF1
SCHEMBL9905004 0.78 PLA2G7 (0.54) PLA2G7GPR84CDK8BRAFRAF1
SCHEMBL9904850 0.77 PLA2G7 (0.58) PLA2G7GPR84BRAFRAF1
SCHEMBL9900883 0.76 PLA2G7 (0.53) PLA2G7GPR84CDK8BRAFRAF1
SCHEMBL9901373 0.76 PLA2G7 (0.54) PLA2G7PPARGNSD2ABL1RIN1
SCHEMBL9904927 0.76 PLA2G7 (0.52) PLA2G7GPR84CDK8BRAFRAF1
SCHEMBL9108191 0.75 PLA2G7 (0.58) PLA2G7GPR84CDK8BRAFRAF1
SCHEMBL9901378 0.74 IDO1 (0.49) PLA2G7GPR84BRAFRAF1PPARG

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-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
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
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
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 773/4885CDK8 1764/4885

“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.