SCHEMBL15280353

SCHEMBL15280353

O=c1nc(OCCc2ccc(Oc3ccc(Cl)c(C(F)(F)F)c3)cn2)cc[nH]1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 4/20 0.46
PLA2G7 Q13093 10/20 0.45
GPR84 Q9NQS5 1/20 0.39
HDAC3 O15379 4/20 0.39
HDAC4 P56524 4/20 0.39
HDAC1 Q13547 4/20 0.39
HDAC7 Q8WUI4 4/20 0.39
HDAC2 Q92769 4/20 0.39
HDAC10 Q969S8 4/20 0.39
HDAC11 Q96DB2 4/20 0.39
HDAC8 Q9BY41 4/20 0.39
HDAC6 Q9UBN7 4/20 0.39
HDAC9 Q9UKV0 4/20 0.39
HDAC5 Q9UQL6 4/20 0.39
BRAF P15056 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
SCHEMBL9923419 0.90 CDK8 (0.47) CDK8PLA2G7
SCHEMBL9900892 0.88 PLA2G7 (0.54) CDK8PLA2G7GPR84HDAC3HDAC4
SCHEMBL15277234 0.85 KDM4E (0.40) GPR84
SCHEMBL9923493 0.84 PLA2G7 (0.47) CDK8PLA2G7GPR84HDAC3HDAC4
SCHEMBL15261929 0.83 PLA2G7 (0.43) CDK8PLA2G7GPR84
SCHEMBL9923483 0.82 PLA2G7 (0.44) CDK8PLA2G7GPR84BRAF
SCHEMBL9904370 0.82 PLA2G7 (0.54) CDK8PLA2G7
SCHEMBL9901511 0.80 PLA2G7 (0.47) CDK8PLA2G7GPR84HDAC3HDAC4
SCHEMBL9923492 0.78 PLA2G7 (0.51) PLA2G7GPR84
SCHEMBL14667698 0.76 CTSS (0.47) CDK8PLA2G7GPR84

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 2 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-20130252986-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-09-26 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-20130252986-A1 COMPOUNDS LIPG, ENPP2, PLA2G1B CDK8 1764/4885PLA2G7 6/4885GPR84 773/4885

“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.