SCHEMBL600419

SCHEMBL600419

Cc1c(Nc2ccnc3ccc(S(=O)(=O)C(C)(C)C)cc23)n[nH]c1CO

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 17/20 0.76
KCNH2 Q12809 9/20 0.76
GAK O14976 3/20 0.62
MAPK14 Q16539 2/20 0.62
LCK P06239 1/20 0.62
TGFBR1 P36897 1/20 0.62
RIPK3 Q9Y572 1/20 0.62
RET P07949 2/20 0.43
KDR P35968 2/20 0.43
PKMYT1 Q99640 1/20 0.43

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
SCHEMBL601819 0.87 RIPK2 (1.00) RIPK2KCNH2GAKMAPK14LCK
SCHEMBL599745 0.86 RIPK2 (0.76) RIPK2KCNH2GAKMAPK14LCK
Water SCHEMBL601248 0.86 RIPK2 (0.98) RIPK2KCNH2GAKMAPK14LCK
SCHEMBL12503537 0.85 RIPK2 (0.78) RIPK2KCNH2GAKMAPK14LCK
SCHEMBL600813 0.83 RIPK2 (0.78) RIPK2KCNH2GAKMAPK14LCK
SCHEMBL599475 0.83 RIPK2 (0.71) RIPK2KCNH2GAKMAPK14LCK
SCHEMBL12496183 0.83 RIPK2 (0.78) RIPK2KCNH2GAKMAPK14LCK
SCHEMBL600404 0.80 RIPK2 (0.76) RIPK2KCNH2GAKMAPK14LCK
SCHEMBL2593012 0.79 RIPK2 (0.77) RIPK2KCNH2GAKMAPK14LCK
SCHEMBL627303 0.79 RIPK2 (0.84) RIPK2KCNH2GAKMAPK14LCK

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-2603218-A1 QUINOLYL AMINES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2013-06-19 EP claimed
WO-2012021580-A1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2012-02-16 WO claimed
US-20160060249-A1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2016-03-03 US disclosed
US-20160060249-A1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2016-03-03 US disclosed
EP-2603218-B1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2016-03-02 EP disclosed
US-20140256949-A1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2014-09-11 US disclosed
US-20140256949-A1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2014-09-11 US disclosed
EP-2603218-A1 QUINOLYL AMINES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2013-06-19 EP disclosed
WO-2012021580-A1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2012-02-16 WO disclosed
US-20120041024-A1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2012-02-16 US disclosed
US-20120041024-A1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2012-02-16 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 (3 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-20120041024-A1 QUINOLYL AMINES AS KINASE INHIBITORS ABL1, MAP3K20, MAP3K19 RIPK2 480/4885KCNH2 824/4885GAK 249/4885
US-20160060249-A1 QUINOLYL AMINES AS KINASE INHIBITORS ABL1, MAP3K20, MAP3K19 RIPK2 480/4885KCNH2 824/4885GAK 249/4885
US-20140256949-A1 QUINOLYL AMINES AS KINASE INHIBITORS ABL1, MAP3K20, MAP3K19 RIPK2 480/4885KCNH2 824/4885GAK 249/4885

“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.