SCHEMBL2217082

SCHEMBL2217082

Cc1c(F)cc(C(=O)Nc2ccnn2C)cc1-c1ccc(C(=O)c2ccc(F)cc2)c(Cl)n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.39
HPGDS O60760 1/20 0.36
CYP2C9 P11712 7/20 0.35
MAPK11 Q15759 3/20 0.35
RAB9A P51151 1/20 0.35
SCN10A Q9Y5Y9 1/20 0.35
BUB1 O43683 1/20 0.35
PRKACG P22612 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
ACSL5 Q9ULC5 1/20 0.35
STK24 Q9Y6E0 1/20 0.35
NTRK1 P04629 2/20 0.34
MAPK8 P45983 1/20 0.34
MAPK10 P53779 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL2214625 0.85 MAPK14 (0.40) MAPK14HPGDSCYP2C9MAPK11BUB1
SCHEMBL2215902 0.80 MAPK14 (0.55) MAPK14CYP2C9MAPK11BUB1PRKACG
SCHEMBL2215646 0.78 CSNK1D (0.37) MAPK14HPGDSNTRK1
SCHEMBL2217937 0.78 KDM4E (0.39) NTRK1
SCHEMBL4739276 0.76 MAPK14 (0.46) MAPK14HPGDSCYP2C9MAPK11BUB1
SCHEMBL2216170 0.72 KDM4E (0.39) MAPK14HPGDSCYP2C9MAPK11NTRK1
SCHEMBL2216235 0.72 MAPK14 (0.43) MAPK14HPGDSCYP2C9MAPK11RAB9A
SCHEMBL4738292 0.72 MAPK14 (0.65) MAPK14HPGDSCYP2C9MAPK11BUB1
SCHEMBL4800075 0.72 MAPK14 (0.65) MAPK14HPGDSCYP2C9MAPK11BUB1
SCHEMBL2213762 0.71 MAPK1 (0.44)

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 5 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
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 14/4885HPGDS 118/4885CYP2C9 2372/4885

“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.