SCHEMBL13054643

SCHEMBL13054643

CCCCOC(=O)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc3c(=O)[nH][nH]c3c2)n1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 19/20 0.46
AURKA O14965 15/20 0.46
ABL1 P00519 1/20 0.41
BCR P11274 1/20 0.41
SRC P12931 1/20 0.39
GSK3B P49841 1/20 0.39
IGF1R P08069 1/20 0.38

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
SCHEMBL13054649 0.88 AURKB (0.49) AURKBAURKAABL1BCRSRC
SCHEMBL13054650 0.84 AURKB (0.48) AURKBAURKAABL1BCRSRC
SCHEMBL13054657 0.84 AURKB (0.44) AURKBAURKAABL1BCRSRC
SCHEMBL12430844 0.82 AURKB (0.70) AURKBAURKAABL1BCRSRC
SCHEMBL13054652 0.79 AURKA (0.51) AURKBAURKAABL1BCRSRC
SCHEMBL13054701 0.78 AURKB (0.45) AURKBAURKAABL1BCRSRC
SCHEMBL13054631 0.78 AURKA (0.59) AURKBAURKASRCGSK3B
SCHEMBL13054617 0.77 AURKA (0.51) AURKBAURKASRCGSK3B
SCHEMBL13054659 0.76 AURKB (0.41) AURKBAURKAABL1BCRSRC
SCHEMBL13054705 0.76 AURKB (0.44) AURKBAURKASRCGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842712-B2 Indazolinone compositions useful as kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-11-30 US disclosed
US-20090048250-A1 INDAZOLINONE COMPOSITIONS USEFUL AS KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2009-02-19 US disclosed
US-7262200-B2 Indazolinone compositions useful as kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-08-28 US disclosed
US-7262200-B2 Indazolinone compositions useful as kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-08-28 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 (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-20090048250-A1 INDAZOLINONE COMPOSITIONS USEFUL AS KINASE INHIBITORS LCK, CDK2, MKNK2 AURKB 18/4885AURKA 10/4885ABL1 196/4885

“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.