SCHEMBL4505212

SCHEMBL4505212

CC(C)(C)c1cc(NC(=O)Oc2ccccc2)n(-c2cccc(OCCOC3CCCCO3)c2)n1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.48
MAPK13 O15264 11/20 0.48
MAPK12 P53778 11/20 0.48
MAPK11 Q15759 11/20 0.48
MAPK9 P45984 3/20 0.46
CDK8 P49336 3/20 0.46
GAA P10253 1/20 0.46
RECQL P46063 1/20 0.44
JAK2 O60674 1/20 0.44
DDR2 Q16832 1/20 0.42
TNF P01375 1/20 0.42

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
SCHEMBL4250862 0.93 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL16398841 0.91 GAA (0.44) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL15006786 0.88 GAA (0.42) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL4071373 0.85 MAPK14 (0.41) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL4139540 0.82 MEN1 (0.40) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL1410655 0.81 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL16279275 0.81 RAF1 (0.37) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL4076105 0.80 KDM4C (0.41) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL15007855 0.80 MAPK14 (0.37) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL16279857 0.79 GAA (0.39) MAPK14MAPK13MAPK12MAPK11MAPK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PFIZER INC. 2009-10-29 US disclosed
EP-1987022-A1 PYRIDINONE PYRAZOLE UREA AND PYRIMIDINONE PYRAZOLE UREA DERIVATIVES Pfizer Products Inc. (US) 2008-11-05 EP disclosed
WO-2007091176-A1 PYRIDINONE PYRAZOLE UREA AND PYRIMIDINONE PYRAZOLE UREA DERIVATIVES PFIZER PRODUCTS INC. (US) 2007-08-16 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-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PDXK, UMPS, CDK2 MAPK14 117/4885MAPK13 130/4885MAPK12 178/4885

“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.