SCHEMBL13054529

SCHEMBL13054529

COCc1cc(Nc2cc(C)[nH]n2)nc(Nc2ccc3c(=O)[nH][nH]c3c2)n1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AURKA O14965 18/20 0.42
AURKB Q96GD4 6/20 0.42
PIK3C3 Q8NEB9 1/20 0.40
SYK P43405 1/20 0.39

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
SCHEMBL13054535 0.89 PIK3C3 (0.42) AURKAAURKBPIK3C3
SCHEMBL13054526 0.85 DOT1L (0.51) AURKAAURKBPIK3C3
SCHEMBL13840498 0.82 AURKA (0.50) AURKAAURKBPIK3C3
SCHEMBL13054516 0.80 AURKA (0.49) AURKAAURKBPIK3C3SYK
SCHEMBL12430948 0.80 AURKA (0.58) AURKAAURKBPIK3C3
SCHEMBL12430950 0.80 AURKA (0.55) AURKAAURKBPIK3C3
SCHEMBL13054518 0.79 AURKA (0.45) AURKAAURKBPIK3C3
SCHEMBL13054528 0.77 AURKA (0.47) AURKAAURKBPIK3C3SYK
SCHEMBL13054863 0.77 SYK (0.41) AURKAAURKBPIK3C3SYK
SCHEMBL13054462 0.75 AURKA (0.53) AURKA

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 6 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-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-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 AURKA 10/4885AURKB 18/4885PIK3C3 220/4885

“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.