SCHEMBL4470408

SCHEMBL4470408

CCOC(Cn1ccc(OCc2ccccc2)cc1=O)OCC

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.64
MCHR1 Q99705 11/20 0.54
KCNH2 Q12809 3/20 0.47
PKM P14618 1/20 0.46

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
SCHEMBL4484736 0.83 MAPK14 (0.76) MAPK14MCHR1KCNH2
SCHEMBL3522184 0.79 PKM (0.44) MAPK14MCHR1KCNH2PKM
SCHEMBL2177074 0.78 MAPK14 (1.00) MAPK14MCHR1
SCHEMBL1038310 0.78 MAPK14 (0.68) MAPK14MCHR1KCNH2
SCHEMBL1523159 0.77 MAPK14 (0.67) MAPK14MCHR1KCNH2
SCHEMBL18913970 0.77 MAPK14 (0.62) MAPK14MCHR1
SCHEMBL4470849 0.75 MAPK14 (0.68) MAPK14MCHR1
SCHEMBL5010203 0.75 MAPK14 (0.68) MAPK14MCHR1KCNH2
SCHEMBL2892861 0.75 MCHR1 (0.51) MAPK14MCHR1KCNH2
SCHEMBL4045555 0.75 MAPK14 (0.72) MAPK14MCHR1

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 41/4885MCHR1 3346/4885KCNH2 2208/4885
US-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 MAPK14 53/4885MCHR1 3032/4885KCNH2 2087/4885

“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.