SCHEMBL2595327

SCHEMBL2595327

CS(=O)(=O)c1ccc2nccc(Nc3ccc(Oc4ccccc4)cc3)c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 1/20 0.64
RIPK2 O43353 5/20 0.62
GAK O14976 2/20 0.61
KDR P35968 2/20 0.59
RET P07949 1/20 0.54
MAPK14 Q16539 1/20 0.54
PKMYT1 Q99640 1/20 0.54
HTT P42858 1/20 0.50
TGFBR1 P36897 4/20 0.49
MAP4K4 O95819 2/20 0.49
MAPKAPK2 P49137 1/20 0.47
PDE4B Q07343 1/20 0.47
RIPK1 Q13546 2/20 0.47
RIPK3 Q9Y572 1/20 0.46
RAF1 P04049 1/20 0.45
BRAF P15056 1/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
NTSR1 P30989 1/20 0.45

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
SCHEMBL2595061 0.89 RIPK2 (0.68) RIPK2GAKKDRRETMAPK14
SCHEMBL2595235 0.82 RIPK2 (0.55) ERBB2RIPK2GAKKDRRET
SCHEMBL14718858 0.82 RIPK2 (0.72) RIPK2GAKKDRRETMAPK14
SCHEMBL2589187 0.82 RIPK2 (0.69) RIPK2GAKKDRRETMAPK14
SCHEMBL2596055 0.82 RIPK2 (0.69) RIPK2GAKKDRRETMAPK14
SCHEMBL2589403 0.82 GAK (0.67) ERBB2RIPK2GAKKDRRET
Trifluoroacetic Acid SCHEMBL14717998 0.81 RIPK2 (0.58) RIPK2GAKKDRRETMAPK14
SCHEMBL28133700 0.80 ERBB2 (0.71) ERBB2RIPK2GAKKDRHTT
SCHEMBL1387165 0.79 ERBB2 (1.00) ERBB2RIPK2GAKKDRHTT
Hydrochloric Acid SCHEMBL8812168 0.78 ERBB2 (0.97) ERBB2RIPK2GAKKDRHTT

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 13 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-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
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 ERBB2 87/4885RIPK2 326/4885GAK 162/4885
US-20130053375-A1 AMINO-QUINOLINES AS KINASE INHIBITORS ABL1, MAP3K2, MAP4K2 ERBB2 87/4885RIPK2 326/4885GAK 162/4885

“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.