SCHEMBL600708

SCHEMBL600708

Cc1n[nH]c(Nc2ccnc3ccc([S@@+]([O-])C4CCOCC4)cc23)c1C

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 10/20 0.37
KCNH2 Q12809 6/20 0.36
MAPKAPK2 P49137 4/20 0.32
LRRK2 Q5S007 2/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
RET P07949 2/20 0.32
MAPK14 Q16539 2/20 0.31
HTR1A P08908 1/20 0.31
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
KDR P35968 1/20 0.31
PKMYT1 Q99640 1/20 0.31
SLC2A1 P11166 1/20 0.31
GAK O14976 1/20 0.30
LCK P06239 1/20 0.30
TGFBR1 P36897 1/20 0.30
RIPK3 Q9Y572 1/20 0.30

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
SCHEMBL600385 1.00 RIPK2 (0.37) RIPK2KCNH2MAPKAPK2LRRK2GSK3A
SCHEMBL600967 1.00 RIPK2 (0.37) RIPK2KCNH2MAPKAPK2LRRK2GSK3A
SCHEMBL10106405 0.86 RIPK2 (0.52) RIPK2KCNH2MAPKAPK2LRRK2RET
SCHEMBL10106406 0.86 RIPK2 (0.52) RIPK2KCNH2MAPKAPK2LRRK2RET
SCHEMBL600738 0.78 RIPK2 (0.38) RIPK2KCNH2MAPKAPK2LRRK2GSK3A
SCHEMBL2589406 0.74 GAK (0.46) RIPK2MAPKAPK2GAKLCK
SCHEMBL14730873 0.72 EGFR (0.43) RIPK2GAKLCK
SCHEMBL601013 0.71 RIPK2 (0.61) RIPK2KCNH2RETMAPK14KDR
SCHEMBL12496271 0.70 RIPK2 (0.55) RIPK2KCNH2LRRK2KDRGAK
SCHEMBL601536 0.70 RIPK2 (0.44) RIPK2KCNH2RETMAPK14KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2603218-B1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2016-03-02 EP claimed
US-20140256949-A1 QUINOLYL AMINES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2014-09-11 US claimed
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
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
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

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 824/4885MAPKAPK2 57/4885
US-20160060249-A1 QUINOLYL AMINES AS KINASE INHIBITORS ABL1, MAP3K20, MAP3K19 RIPK2 480/4885KCNH2 824/4885MAPKAPK2 57/4885
US-20140256949-A1 QUINOLYL AMINES AS KINASE INHIBITORS ABL1, MAP3K20, MAP3K19 RIPK2 480/4885KCNH2 824/4885MAPKAPK2 57/4885

“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.