SCHEMBL13175607

SCHEMBL13175607

Cc1cc(Nc2nc(-c3cccc(S(C)(=O)=O)c3)nn3cccc23)n[nH]1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 16/20 0.53
HDAC1 Q13547 1/20 0.46
AURKA O14965 2/20 0.46
AURKB Q96GD4 2/20 0.46
AURKC Q9UQB9 2/20 0.46
TGFBR1 P36897 1/20 0.46

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
SCHEMBL13221382 0.92 JAK2 (0.51) JAK2HDAC1AURKAAURKBAURKC
SCHEMBL13175629 0.85 JAK2 (0.61) JAK2AURKAAURKB
SCHEMBL13221384 0.80 JAK2 (0.49) JAK2HDAC1AURKAAURKBAURKC
SCHEMBL13221381 0.79 AURKA (0.41) JAK2AURKAAURKB
SCHEMBL12922948 0.77 JAK2 (0.67) JAK2AURKAAURKBAURKC
SCHEMBL15759458 0.75 JAK2 (0.64) JAK2HDAC1AURKAAURKBAURKC
SCHEMBL12314108 0.75 JAK2 (0.64) JAK2AURKAAURKBAURKC
SCHEMBL2916720 0.75 SYK (0.41) JAK2AURKAAURKB
SCHEMBL13221645 0.74 AURKA (0.45) JAK2HDAC1AURKAAURKBAURKC
SCHEMBL12102305 0.72 JAK2 (0.59) JAK2HDAC1AURKAAURKBAURKC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812439-B2 KINASE INHIBITORS TAKEDA PHARMACEUTICALS CO (JP) 2017-12-06 EP disclosed
US-8288536-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-16 US disclosed
US-8288536-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-16 US disclosed
EP-1812439-B1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2010-09-01 EP disclosed
US-20100216765-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-26 US disclosed
US-20100216765-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-26 US disclosed
US-7713973-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-11 US disclosed
US-7713973-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-11 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 (1 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-20100216765-A1 KINASE INHIBITORS MAP3K20, MAP3K19, MAP3K1 JAK2 55/4885HDAC1 1131/4885AURKA 161/4885

“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.