SCHEMBL4498433

SCHEMBL4498433

COC(=O)c1ccc(C)c(-n2c(C)cc(OCc3ccccc3CN)c(Cl)c2=O)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.47
ROCK2 O75116 1/20 0.45
MAPK12 P53778 1/20 0.45
MAPK11 Q15759 1/20 0.45
STRADA Q7RTN6 1/20 0.45
ALDH1A1 P00352 2/20 0.44
OPRK1 P41145 1/20 0.44
MAPK1 P28482 1/20 0.39
MAPKAPK5 Q8IW41 1/20 0.39
LMNA P02545 1/20 0.39
HDAC8 Q9BY41 1/20 0.38
MAPKAPK2 P49137 2/20 0.38

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
SCHEMBL14434818 0.90 MAPK14 (0.48) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL14434890 0.90 MAPK14 (0.57) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4507620 0.89 MAPK14 (0.56) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL13678565 0.87 MAPK14 (0.43) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL13678563 0.86 MAPK14 (0.44) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4377137 0.82 MAPK14 (0.67) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL5026231 0.80 MAPK14 (0.53) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4514115 0.79 MAPK14 (0.70) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL14434864 0.79 MAPK14 (0.47) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4499164 0.79 MAPK14 (0.53) MAPK14ROCK2MAPK12MAPK11STRADA

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 6 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
US-20090270350-A1 Pyridinone Pyrazole Urea and Pyrimidinone Pyrazole Urea Derivatives PFIZER INC. 2009-10-29 US disclosed
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
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 117/4885ROCK2 276/4885MAPK12 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.