SCHEMBL14718302

SCHEMBL14718302

O=S(=O)(c1ccc2nccc(Nc3ccc4scnc4c3)c2c1)N1CCS(O)(O)CC1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 4/20 0.66
KDR P35968 2/20 0.66
RIPK3 Q9Y572 4/20 0.62
RIPK1 Q13546 3/20 0.62
CHRM5 P08912 7/20 0.51
BRAF P15056 1/20 0.46
PDGFRA P16234 1/20 0.46
ACVR1B P36896 1/20 0.46
PIK3CA P42336 1/20 0.46
EGFR P00533 1/20 0.46
TGFBR1 P36897 1/20 0.46
IKBKB O14920 5/20 0.45
CHUK O15111 3/20 0.44

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
SCHEMBL12180679 0.92 RIPK2 (0.67) RIPK2KDRRIPK3RIPK1CHRM5
SCHEMBL2589399 0.90 RIPK2 (0.71) RIPK2KDRRIPK3RIPK1CHRM5
SCHEMBL2595380 0.89 RIPK2 (0.71) RIPK2KDRRIPK3RIPK1CHRM5
SCHEMBL2595945 0.89 RIPK2 (0.70) RIPK2KDRRIPK3RIPK1CHRM5
SCHEMBL2595108 0.88 RIPK2 (0.69) RIPK2KDRRIPK3RIPK1CHRM5
SCHEMBL2589413 0.87 RIPK2 (0.68) RIPK2KDRRIPK3RIPK1CHRM5
SCHEMBL2595087 0.87 RIPK2 (0.68) RIPK2KDRRIPK3RIPK1CHRM5
Hydrochloric Acid SCHEMBL14718163 0.86 RIPK2 (0.67) RIPK2KDRRIPK3RIPK1CHRM5
Hydrochloric Acid SCHEMBL14718278 0.86 RIPK2 (0.67) RIPK2KDRRIPK3RIPK1CHRM5
SCHEMBL12180664 0.84 RIPK2 (0.64) RIPK2KDRRIPK3RIPK1CHRM5

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 5 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
EP-2566477-B1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2015-09-02 EP disclosed
US-20130053375-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXO GROUP LIMITED 2013-02-28 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 (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 404/4885RIPK3 421/4885
US-20130053375-A1 AMINO-QUINOLINES AS KINASE INHIBITORS ABL1, MAP3K2, MAP4K2 RIPK2 326/4885KDR 404/4885RIPK3 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.