SCHEMBL4946909

SCHEMBL4946909

CSc1nc(-c2ccc(F)cc2F)c2ccc(=O)n(-c3c(F)cc(F)cc3F)c2n1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.51
MAPK11 Q15759 10/20 0.51
MAPK13 O15264 9/20 0.51
MAPK12 P53778 9/20 0.51
KCNH2 Q12809 1/20 0.51
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 2/20 0.35

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
SCHEMBL4473185 0.90 MAPK14 (0.45) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL4470039 0.89 MAPK14 (0.46) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL6859846 0.89 MAPK14 (0.58) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL1065155 0.85 MAPK14 (0.50) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL14028120 0.83 MAPK14 (0.48) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL4463596 0.82 MAPK14 (0.51) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL1061075 0.82 MAPK14 (0.45) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL1063961 0.82 HSP90AB1 (0.44) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL4945708 0.81 MAPK13 (0.38) MAPK14MAPK11MAPK13MAPK12KCNH2
SCHEMBL14534029 0.81 MAPK14 (0.38) MAPK14MAPK11MAPK13MAPK12KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080268044-A1 Novel Process and Formulations GLAXO GROUP LIMITED 2008-10-30 US claimed
US-7629350-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-12-08 US disclosed
US-7629350-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-12-08 US disclosed
US-20080268044-A1 Novel Process and Formulations GLAXO GROUP LIMITED 2008-10-30 US disclosed
US-20080268044-A1 Novel Process and Formulations GLAXO GROUP LIMITED 2008-10-30 US disclosed
US-20080268044-A1 Novel Process and Formulations GLAXO GROUP LIMITED 2008-10-30 US disclosed
EP-1499320-B1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2007-08-22 EP disclosed
EP-1499320-B1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2007-08-22 EP disclosed
WO-2007059500-A2 NOVEL PROCESS AND FORMULATIONS GLAXO GROUP LIMITED (GB) 2007-05-24 WO disclosed
EP-1499320-A4 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2006-05-17 EP disclosed
EP-1499320-A1 NOVEL COMPOUNDS SmithKline Beecham Corporation (US) 2005-01-26 EP disclosed
WO-2003088972-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2003-10-30 WO 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-20080268044-A1 Novel Process and Formulations UGT1A7, UGT2B7, CYP3A7 MAPK14 2969/4885MAPK11 2124/4885MAPK13 2574/4885

“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.