SCHEMBL6832405

SCHEMBL6832405

CC(=O)N1CN(C(=O)CC(C)(C)O)c2ccc(Cn3ccc(OCc4ccc(F)cc4F)c(Cl)c3=O)cc21.CC(=O)N1CN(C(N)=O)c2ccc(Cn3ccc(OCc4ccc(F)cc4F)c(Cl)c3=O)cc21

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.43
MAPKAPK2 P49137 1/20 0.36
PTGER1 P34995 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
SCHEMBL4476941 0.97 MAPK14 (0.45) MAPK14MAPKAPK2PTGER1
SCHEMBL4474772 0.97 MAPK14 (0.45) MAPK14MAPKAPK2PTGER1
SCHEMBL4468368 0.96 MAPK14 (0.46) MAPK14MAPKAPK2PTGER1
SCHEMBL4478104 0.96 MAPK14 (0.46) MAPK14MAPKAPK2PTGER1
SCHEMBL5861917 0.94 MAPK14 (0.48) MAPK14MAPKAPK2PTGER1
SCHEMBL4477099 0.93 MAPK14 (0.48) MAPK14
SCHEMBL4485548 0.93 MAPK14 (0.48) MAPK14
SCHEMBL4477064 0.91 MAPK14 (0.46) MAPK14MAPKAPK2PTGER1
SCHEMBL4478822 0.91 MAPK14 (0.46) MAPK14MAPKAPK2PTGER1
SCHEMBL4466224 0.90 MAPK14 (0.45) MAPK14MAPKAPK2PTGER1

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-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 US claimed

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-20040058964-A1 Substituted pyridinones MAPK1, MAPK6, MAPK7 MAPK14 41/4885MAPKAPK2 25/4885PTGER1 170/4885

“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.