SCHEMBL4100742

SCHEMBL4100742

CNC(=O)c1ccc(C)c(Oc2ncnn3cc(C(=O)OC)c(C)c23)c1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 17/20 0.68
▸ KDR P35968 3/20 0.55

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
SCHEMBL7247425 0.91 MAPK14 (0.56) MAPK14
SCHEMBL4045888 0.76 KDR (0.65) MAPK14KDR
SCHEMBL1461091 0.74 KDR (0.65) MAPK14KDR
SCHEMBL13755665 0.72 MAPK14 (0.87) MAPK14
SCHEMBL4108826 0.72 MAPK14 (0.85) MAPK14
SCHEMBL5511762 0.71 KDR (0.79) MAPK14KDR
SCHEMBL1226861 0.71 KDR (1.00) MAPK14KDR
SCHEMBL12729599 0.71 MAPK14 (0.80) MAPK14
SCHEMBL4048119 0.70 KDR (0.52) MAPK14KDR
SCHEMBL16576239 0.70 MAPK14 (1.00) MAPK14

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-20090227567-A1 METHODS OF TREATING P38 KINASE-ASSOCIATED CONDITIONS AND PYRROLOTRIAZINE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2009-09-10 — — 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-20090227567-A1 METHODS OF TREATING P38 KINASE-ASSOCIATED CONDITIONS AND PYRROLOTRIAZINE COMPOUNDS USEFUL AS KINASE INHIBITORS MAP3K5, MAPK1, MAPKAPK5 MAPK14 29/4885KDR 3537/4885

“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.

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