SCHEMBL3767239

SCHEMBL3767239

O=c1[nH][nH]c2cc(Nc3nc(Nc4cc(C5CC5)n[nH]4)c4ccc(Cl)cc4n3)ccc12

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 3/20 0.40
DAO P14920 1/20 0.39
ULK1 O75385 4/20 0.37
PDK1 Q15118 1/20 0.37
ULK2 Q8IYT8 1/20 0.37
PAK4 O96013 4/20 0.36
NPY5R Q15761 2/20 0.35
SOS1 Q07889 4/20 0.35
PAK1 Q13153 1/20 0.34
IGF1R P08069 1/20 0.34
NTRK3 Q16288 1/20 0.33
NTRK2 Q16620 1/20 0.33

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
SCHEMBL3769388 0.94 NTRK1 (0.40) NTRK1DAOULK1PDK1ULK2
SCHEMBL3767353 0.90 ULK1 (0.47) NTRK1ULK1PDK1ULK2NPY5R
SCHEMBL3757377 0.87 ULK1 (0.51) ULK1PDK1ULK2NPY5RSOS1
SCHEMBL3767787 0.87 ULK1 (0.49) ULK1PDK1ULK2NPY5RSOS1
SCHEMBL3772000 0.86 ULK1 (0.37) NTRK1ULK1PDK1ULK2PAK4
SCHEMBL13054444 0.85 NTRK1 (0.57) NTRK1ULK1PDK1ULK2PAK4
SCHEMBL3767946 0.84 ULK1 (0.40) ULK1PDK1ULK2PAK4NPY5R
SCHEMBL3763985 0.84 DAO (0.36) DAO
SCHEMBL3762117 0.83 SYK (0.35) ULK1PDK1ULK2PAK4
SCHEMBL3762734 0.83 ULK1 (0.38) ULK1PDK1ULK2PAK4NPY5R

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 NTRK1 1472/4885DAO 3368/4885ULK1 575/4885
US-20090048250-A1 INDAZOLINONE COMPOSITIONS USEFUL AS KINASE INHIBITORS LCK, CDK2, MKNK2 NTRK1 1279/4885DAO 3229/4885ULK1 585/4885

“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.