SCHEMBL4474798

SCHEMBL4474798

CC(C)(O)CC(=O)N1CCc2c(cccc2Cn2ccc(OCc3ccc(F)cc3F)c(Cl)c2=O)C1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.42
MAPKAPK2 P49137 2/20 0.37
ENPP2 Q13822 1/20 0.37
PREP P48147 1/20 0.36
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL4482086 0.91 MAPK14 (0.43) MAPK14MAPKAPK2PREP
SCHEMBL4478478 0.90 MAPK14 (0.45) MAPK14ENPP2PREPL3MBTL1
SCHEMBL4473241 0.90 MAPK14 (0.45) MAPK14PREP
SCHEMBL4469998 0.89 MAPK14 (0.42) MAPK14PREPPTGDR2
SCHEMBL4469329 0.89 MAPK14 (0.44) MAPK14ENPP2PREPALDH1A1L3MBTL1
SCHEMBL4478992 0.88 MAPK14 (0.45) MAPK14PREPALDH1A1L3MBTL1
SCHEMBL3521949 0.88 MAPK14 (0.41) MAPK14MAPKAPK2ENPP2ALDH1A1L3MBTL1
SCHEMBL4475400 0.86 MAPK14 (0.45) MAPK14MAPKAPK2PREPALDH1A1L3MBTL1
SCHEMBL4478621 0.83 MAPK14 (0.47) MAPK14MAPKAPK2
SCHEMBL4462392 0.83 MAPK14 (0.47) MAPK14PTGDR2

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-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 US claimed
US-7629363-B2 antiinflammatory agent for treating asthma and chronic pulmonary inflammatory disease PFIZER INC (US) 2009-12-08 US disclosed
US-7067540-B2 Substituted pyridinones PHARMACIA CORPORATION (US) 2006-06-27 US disclosed
US-20050176775-A1 Substituted pyridinones PHARMACIA CORPORATION 2005-08-11 US disclosed
WO-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO disclosed
US-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 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 (2 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-20040058964-A1 Substituted pyridinones MAPK1, MAPK6, MAPK7 MAPK14 41/4885MAPKAPK2 25/4885ENPP2 1501/4885
US-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 MAPK14 53/4885MAPKAPK2 33/4885ENPP2 1034/4885

“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.