SCHEMBL2594980

SCHEMBL2594980

CC(C)S(=O)(=O)c1ccc2nccc(Nc3n[nH]c4c(C(F)(F)F)cccc34)c2c1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 14/20 0.63
KCNH2 Q12809 8/20 0.49
RIPK3 Q9Y572 2/20 0.49
MAPK14 Q16539 2/20 0.49
GAK O14976 2/20 0.49
LCK P06239 1/20 0.49
TGFBR1 P36897 1/20 0.49
RIPK1 Q13546 2/20 0.48
NR1H2 P55055 2/20 0.42
NR1H3 Q13133 2/20 0.42
RAF1 P04049 1/20 0.39
BRAF P15056 1/20 0.39
RET P07949 1/20 0.37
KDR P35968 1/20 0.37
PKMYT1 Q99640 1/20 0.37
HRH4 Q9H3N8 1/20 0.36

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
SCHEMBL2595976 0.82 RIPK2 (0.77) RIPK2KCNH2RIPK3MAPK14GAK
SCHEMBL600965 0.81 RIPK2 (0.65) RIPK2KCNH2RIPK3MAPK14GAK
SCHEMBL600919 0.78 RIPK2 (0.74) RIPK2KCNH2RIPK3MAPK14GAK
SCHEMBL2595069 0.77 RIPK2 (1.00) RIPK2KCNH2RIPK3MAPK14GAK
SCHEMBL2594972 0.74 RIPK2 (0.76) RIPK2KCNH2RIPK3MAPK14GAK
SCHEMBL2596107 0.71 RIPK2 (0.54) RIPK2KCNH2RIPK3MAPK14GAK
SCHEMBL2593012 0.70 RIPK2 (0.77) RIPK2KCNH2RIPK3MAPK14GAK
SCHEMBL2592996 0.70 RIPK2 (0.65) RIPK2KCNH2RIPK3MAPK14GAK
SCHEMBL2595204 0.69 RIPK2 (0.45) RIPK2KCNH2RIPK3MAPK14GAK
SCHEMBL602467 0.69 RIPK2 (0.82) RIPK2KCNH2RIPK3MAPK14GAK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2566477-B1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2015-09-02 EP claimed
US-20130053375-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXO GROUP LIMITED 2013-02-28 US claimed
US-20160060222-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE LLC 2016-03-03 US disclosed
US-20160060222-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE LLC 2016-03-03 US disclosed
US-20160060222-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE LLC 2016-03-03 US disclosed
EP-2566477-B1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2015-09-02 EP disclosed
EP-2566477-A1 AMINO-QUINOLINES AS KINASE INHIBITORS Glaxo Group Limited (GB) 2013-03-13 EP disclosed
US-20130053375-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXO GROUP LIMITED 2013-02-28 US disclosed
US-20130053375-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXO GROUP LIMITED 2013-02-28 US disclosed
US-20130053375-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXO GROUP LIMITED 2013-02-28 US disclosed
WO-2011140442-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-11-10 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 (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-20160060222-A1 AMINO-QUINOLINES AS KINASE INHIBITORS ABL1, MAP3K2, MAP4K2 RIPK2 326/4885KCNH2 1159/4885RIPK3 421/4885
US-20130053375-A1 AMINO-QUINOLINES AS KINASE INHIBITORS ABL1, MAP3K2, MAP4K2 RIPK2 326/4885KCNH2 1159/4885RIPK3 421/4885

“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.