SCHEMBL2589387

SCHEMBL2589387

Cc1n[nH]c2cc(Nc3ccnc4ccc(S(C)(=O)=O)cc34)ccc12

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 10/20 0.68
KDR P35968 2/20 0.59
GAK O14976 2/20 0.55
MAPK14 Q16539 2/20 0.53
RET P07949 1/20 0.53
PKMYT1 Q99640 1/20 0.53
KCNH2 Q12809 4/20 0.51
RAF1 P04049 1/20 0.48
BRAF P15056 1/20 0.48
TGFBR1 P36897 8/20 0.47
RIPK1 Q13546 2/20 0.47
RIPK3 Q9Y572 2/20 0.46
LCK P06239 1/20 0.46
MAP4K4 O95819 4/20 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
SCHEMBL2595136 0.89 RIPK1 (0.62) RIPK2KDRGAKMAPK14RET
SCHEMBL2595405 0.89 RIPK2 (0.64) RIPK2KDRGAKMAPK14RET
SCHEMBL2591752 0.88 RIPK2 (0.67) RIPK2KDRGAKMAPK14RET
SCHEMBL601013 0.81 RIPK2 (0.61) RIPK2KDRGAKMAPK14RET
SCHEMBL2589414 0.81 RIPK2 (0.65) RIPK2KDRGAKMAPK14RET
SCHEMBL17552302 0.81 RIPK2 (0.70) RIPK2KDRGAKMAPK14RET
Hydrochloric Acid SCHEMBL601261 0.80 RIPK2 (0.60) RIPK2KDRGAKMAPK14RET
SCHEMBL2592946 0.80 RIPK2 (0.72) RIPK2KDRGAKMAPK14RET
SCHEMBL2595191 0.80 RIPK2 (0.66) RIPK2KDRGAKMAPK14RET
SCHEMBL2592730 0.79 RIPK2 (0.57) RIPK2KDRGAKMAPK14RET

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
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
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 326/4885KDR 404/4885GAK 162/4885
US-20130053375-A1 AMINO-QUINOLINES AS KINASE INHIBITORS ABL1, MAP3K2, MAP4K2 RIPK2 326/4885KDR 404/4885GAK 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.