SCHEMBL3757474

SCHEMBL3757474

O=c1[nH][nH]c2cc(Nc3ncc(-c4ccccc4)c(Nc4cc(C5CC5)n[nH]4)n3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.41
VRK1 Q99986 2/20 0.38
IGF1R P08069 6/20 0.38
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
AXL P30530 2/20 0.35
TYRO3 Q06418 2/20 0.35
MERTK Q12866 2/20 0.35
ROCK1 Q13464 1/20 0.35
CHEK1 O14757 1/20 0.34
ALK Q9UM73 1/20 0.34
ULK1 O75385 1/20 0.34
PDK1 Q15118 1/20 0.34
ULK2 Q8IYT8 1/20 0.34
MAP4K1 Q92918 1/20 0.34

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
SCHEMBL3762160 0.88 IGF1R (0.41) VRK1IGF1RROCK1ULK1PDK1
SCHEMBL3762074 0.87 CHEK1 (0.37) SYKVRK1IGF1RGSK3AGSK3B
SCHEMBL3767353 0.84 ULK1 (0.47) GSK3BMERTKULK1PDK1ULK2
SCHEMBL3767946 0.84 ULK1 (0.40) GSK3AGSK3BROCK1ULK1PDK1
SCHEMBL3763620 0.83 PDE4B (0.37) SYKVRK1ULK1PDK1ULK2
SCHEMBL3766182 0.83 IGF1R (0.45) VRK1IGF1RGSK3AGSK3B
SCHEMBL13055842 0.82 VRK1 (0.39) SYKVRK1IGF1RGSK3B
SCHEMBL3763605 0.82 SYK (0.40) SYKVRK1IGF1RROCK1ULK1
SCHEMBL3767787 0.81 ULK1 (0.49) GSK3BMERTKULK1PDK1ULK2
SCHEMBL3757377 0.81 ULK1 (0.51) GSK3BMERTKULK1PDK1ULK2

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 10 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-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-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
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 SYK 67/4885VRK1 383/4885IGF1R 682/4885
US-20090048250-A1 INDAZOLINONE COMPOSITIONS USEFUL AS KINASE INHIBITORS LCK, CDK2, MKNK2 SYK 50/4885VRK1 399/4885IGF1R 687/4885

“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.