SCHEMBL4389963

SCHEMBL4389963

CCOC(=O)CCn1ccc(OCc2ccccc2)c(Br)c1=O

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.61
TNF P01375 5/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
GRM2 Q14416 1/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
CREBBP Q92793 1/20 0.41

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
SCHEMBL4385111 0.89 MAPK14 (0.64) MAPK14GRM2KDM4EALDH1A1
SCHEMBL4473993 0.86 MAPK14 (0.70) MAPK14GRM2
SCHEMBL4477627 0.84 MAPK14 (0.67) MAPK14GRM2
SCHEMBL3521531 0.81 MEN1 (0.47) MAPK14TNFMEN1KMT2AKDM4E
SCHEMBL4382431 0.81 MAPK14 (0.77) MAPK14MEN1KMT2AGRM2KDM4E
SCHEMBL5861929 0.78 MAPK14 (0.73) MAPK14KMT2AGRM2
SCHEMBL4470415 0.77 MAPK14 (1.00) MAPK14MEN1KMT2AGRM2ALDH1A1
SCHEMBL4475995 0.77 MAPK14 (0.57) MAPK14MEN1KMT2AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL4481459 0.77 MAPK14 (0.57) MAPK14GRM2
SCHEMBL27779082 0.76 MAPK14 (0.62) MAPK14KMT2AKDM4E

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 9 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-7629363-B2 antiinflammatory agent for treating asthma and chronic pulmonary inflammatory disease PFIZER INC (US) 2009-12-08 US disclosed
US-7629363-B2 antiinflammatory agent for treating asthma and chronic pulmonary inflammatory disease PFIZER INC (US) 2009-12-08 US disclosed
EP-1490064-B1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORP (US) 2009-11-18 EP disclosed
EP-1490064-B1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORP (US) 2009-11-18 EP 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
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 41/4885TNF 140/4885MEN1 4261/4885
US-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 MAPK14 53/4885TNF 94/4885MEN1 3919/4885

“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.