SCHEMBL3767787

SCHEMBL3767787

O=c1[nH][nH]c2cc(Nc3nc(Nc4cc(C5CCCC5)n[nH]4)c4ccccc4n3)ccc12

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 4/20 0.49
PDK1 Q15118 1/20 0.49
ULK2 Q8IYT8 1/20 0.49
NPY5R Q15761 5/20 0.48
MERTK Q12866 5/20 0.43
SOS1 Q07889 4/20 0.40
AURKA O14965 1/20 0.39
SRC P12931 1/20 0.39
GSK3B P49841 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
SCHEMBL3757377 0.98 ULK1 (0.51) ULK1PDK1ULK2NPY5RMERTK
SCHEMBL3767353 0.96 ULK1 (0.47) ULK1PDK1ULK2NPY5RMERTK
SCHEMBL3767946 0.87 ULK1 (0.40) ULK1PDK1ULK2NPY5RSOS1
SCHEMBL3767239 0.87 NTRK1 (0.40) ULK1PDK1ULK2NPY5RSOS1
SCHEMBL3769388 0.86 NTRK1 (0.40) ULK1PDK1ULK2
SCHEMBL3772000 0.85 ULK1 (0.37) ULK1PDK1ULK2NPY5RSOS1
SCHEMBL13054460 0.84 ULK1 (0.69) ULK1PDK1ULK2NPY5RMERTK
SCHEMBL3769795 0.84 AURKA (0.35) ULK1PDK1ULK2SOS1AURKA
SCHEMBL3762734 0.84 ULK1 (0.38) ULK1PDK1ULK2NPY5RSOS1
SCHEMBL3757445 0.83 AURKA (0.47) ULK1PDK1ULK2NPY5RSOS1

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-20040167121-A1 Indazolinone compositions useful as kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED 2004-08-26 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-20040167121-A1 Indazolinone compositions useful as kinase inhibitors LCK, CDK2, CILK1 ULK1 575/4885PDK1 426/4885ULK2 396/4885
US-20090048250-A1 INDAZOLINONE COMPOSITIONS USEFUL AS KINASE INHIBITORS LCK, CDK2, MKNK2 ULK1 585/4885PDK1 422/4885ULK2 385/4885

“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.