SCHEMBL2215405

SCHEMBL2215405

CCCS(=O)(=O)n1ncc2cc(-c3cc(C(=O)NC4CC4)cc(F)c3C)ncc21

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.53
CYP2C9 P11712 10/20 0.51
MAPK11 Q15759 3/20 0.51
BUB1 O43683 1/20 0.50
PRKACG P22612 1/20 0.50
MAPKAPK2 P49137 1/20 0.50
ACSL5 Q9ULC5 1/20 0.50
STK24 Q9Y6E0 1/20 0.50
MAPK13 O15264 4/20 0.41
TTK P33981 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
SCHEMBL2214382 0.88 MAPK14 (0.51) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3524930 0.86 MAPK14 (0.52) MAPK14CYP2C9MAPK13
SCHEMBL2215164 0.86 MAPK14 (0.54) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL2213369 0.84 MAPK14 (0.50) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3524468 0.82 MAPK14 (0.55) MAPK14CYP2C9MAPK13
SCHEMBL2216902 0.81 MAPK14 (0.49) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL2213343 0.81 MAPK14 (0.47) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL3525045 0.80 MAPK14 (0.53) MAPK14CYP2C9MAPK13
SCHEMBL3522907 0.80 MAPK14 (0.53) MAPK14CYP2C9MAPK13
SCHEMBL2216064 0.77 KHK (0.56) MAPK14CYP2C9MAPK11BUB1PRKACG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1709046-B1 P38 KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-07-27 EP disclosed
US-20070161673-A1 P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2007-07-12 US disclosed
US-20070161673-A1 P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2007-07-12 US disclosed
US-20070161673-A1 P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2007-07-12 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 (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-20070161673-A1 P38 kinase inhibitors MAPK1, MAPK7, MAP3K1 MAPK14 14/4885CYP2C9 2372/4885MAPK11 38/4885

“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.