SCHEMBL4288013

SCHEMBL4288013

CC(C)NCCNc1cc(-c2ccccc2Cl)c2ccc(=O)n(-c3ccccc3Cl)c2c1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.44
MAPK13 O15264 4/20 0.42
MAPK12 P53778 4/20 0.42
MAPK11 Q15759 4/20 0.42

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
SCHEMBL4287662 0.82 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4288511 0.80 MAT2A (0.41) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4290162 0.78 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11
Formic Acid SCHEMBL4290417 0.77 MAT2A (0.38) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4299783 0.73 MAPK14 (0.77) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4286135 0.73 MAPK14 (0.78) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4062855 0.69 MAPK14 (0.47) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4299318 0.68 MAPK14 (0.54) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4286319 0.66 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4293125 0.66 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060211727-A1 Novel compounds GLAXOSMITHKLINE LLC 2006-09-21 US claimed
US-20090239897-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-09-24 US disclosed
US-20090239897-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-09-24 US disclosed
US-20090239897-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-09-24 US disclosed
US-7550480-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-06-23 US disclosed
US-7550480-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-06-23 US disclosed
US-7550480-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-06-23 US disclosed
US-20060211727-A1 Novel compounds GLAXOSMITHKLINE LLC 2006-09-21 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-20090239897-A1 NOVEL COMPOUNDS MAPKAPK2, CREBBP, MAPK1 MAPK14 32/4885MAPK13 60/4885MAPK12 61/4885
US-20060211727-A1 Novel compounds MAPKAPK2, CREBBP, MAPK1 MAPK14 32/4885MAPK13 60/4885MAPK12 61/4885

“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.