SCHEMBL4475400

SCHEMBL4475400

CC(C)(O)CC(=O)N1CCc2cc(Cn3ccc(OCc4ccc(F)cc4F)c(Cl)c3=O)ccc2C1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.45
MAPKAPK2 P49137 1/20 0.38
PREP P48147 1/20 0.37
NAMPT P43490 1/20 0.36
CHEK1 O14757 1/20 0.36
FLT3 P36888 1/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL4478621 0.94 MAPK14 (0.47) MAPK14MAPKAPK2NAMPT
SCHEMBL4468290 0.91 MAPK14 (0.46) MAPK14MAPKAPK2PREP
SCHEMBL4489411 0.90 MAPK14 (0.47) MAPK14PREPL3MBTL1
SCHEMBL4467753 0.89 MAPK14 (0.48) MAPK14PREP
SCHEMBL4487452 0.89 MAPK14 (0.45) MAPK14PREP
SCHEMBL4472931 0.89 MAPK14 (0.46) MAPK14PREPALDH1A1L3MBTL1
SCHEMBL4488215 0.88 MAPK14 (0.48) MAPK14PREPALDH1A1L3MBTL1
SCHEMBL3527596 0.88 MAPK14 (0.41) MAPK14NAMPTCHEK1FLT3ALDH1A1
SCHEMBL4485598 0.87 MAPK14 (0.46) MAPK14MAPKAPK2
SCHEMBL4472977 0.86 MAPK14 (0.48) MAPK14MAPKAPK2

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 25/4885PREP 3737/4885
US-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 MAPK14 53/4885MAPKAPK2 33/4885PREP 2978/4885

“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.