SCHEMBL3784202

SCHEMBL3784202

O=C1Nc2ccccc2/C1=C/c1ccc2c(-c3cccnc3)n[nH]c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTK P33981 1/20 0.60
MAPT P10636 1/20 0.60
MAPK1 P28482 1/20 0.60
HTT P42858 1/20 0.60
RAF1 P04049 2/20 0.50
PIK3C3 Q8NEB9 1/20 0.50
AXL P30530 1/20 0.49
IDO1 P14902 1/20 0.48
LRRK2 Q5S007 1/20 0.48
JAK2 O60674 1/20 0.48
JAK3 P52333 1/20 0.48
GSK3B P49841 1/20 0.46
ALK Q9UM73 2/20 0.46
RPS6KA3 P51812 1/20 0.46
PLK4 O00444 2/20 0.46
PLK1 P53350 2/20 0.46
RET P07949 2/20 0.46
FLT3 P36888 2/20 0.46
PDGFRB P09619 1/20 0.46
ABL1 P00519 1/20 0.46

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
SCHEMBL3707158 1.00 TTK (0.60) TTKMAPTMAPK1HTTRAF1
SCHEMBL3707160 1.00 TTK (0.60) TTKMAPTMAPK1HTTRAF1
SCHEMBL3796759 0.90 MAPT (0.50) TTKMAPTMAPK1HTTGSK3B
SCHEMBL3796767 0.90 MAPT (0.50) TTKMAPTMAPK1HTTGSK3B
SCHEMBL12848632 0.90 MAPT (0.50) TTKMAPTMAPK1HTTGSK3B
SCHEMBL6531780 0.89 TTK (0.57) TTKMAPTMAPK1HTTRAF1
SCHEMBL12848346 0.89 TTK (0.57) TTKMAPTMAPK1HTTRAF1
SCHEMBL6531777 0.89 TTK (0.57) TTKMAPTMAPK1HTTRAF1
SCHEMBL12795294 0.89 MAPT (0.51) MAPTMAPK1HTTRAF1PLK4
SCHEMBL12848141 0.87 TTK (0.54) TTKMAPTMAPK1RAF1PIK3C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765748-B2 Indazolyl, benzimidazolyl, benzotriazolyl substituted indolinone derivatives as kinase inhibitors useful in the treatment of cancer UNIVERSITY HEALTH NETWORK (CA) 2014-07-01 US disclosed
US-20110065702-A1 INDAZOLYL, BENZIMIDAZOLYL, BENZOTRIAZOLYL SUBSTITUTED INDOLINONE DERIVATIVES AS KINASE INHIBITORS USEFUL IN THE TREATMENT OF CANCER UNIVERSITY HEALTH NETWORK 2011-03-17 US disclosed
EP-2235004-A1 INDAZOLYL, BENZIMIDAZOLYL, BENZOTRIAZOLYL SUBSTITUTED INDOLMONE DERIVATIVES AS KINASE INHIBITORS USEFUL IN THE TREATMENT OF CANCER University Health Network (CA) 2010-10-06 EP disclosed
WO-2009079767-A9 INDAZOLYL, BENZIMIDAZOLYL, BENZOTRIAZOLYL SUBSTITUTED INDOLINONE DERIVATIVES AS KINASE INHIBITORS USEFUL IN THE TREATMENT OF CANCER UNIVERSITY HEALTH NETWORK (CA) 2009-10-01 WO disclosed
WO-2009079767-A1 INDAZOLYL, BENZIMIDAZOLYL, BENZOTRIAZOLYL SUBSTITUTED INDOLINONE DERIVATIVES AS KINASE INHIBITORS USEFUL IN THE TREATMENT OF CANCER UNIVERSITY HEALTH NETWORK (CA) 2009-07-02 WO 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-20110065702-A1 INDAZOLYL, BENZIMIDAZOLYL, BENZOTRIAZOLYL SUBSTITUTED INDOLINONE DERIVATIVES AS KINASE INHIBITORS USEFUL IN THE TREATMENT OF CANCER TNNI3K, ABL1, TK1 TTK 421/4885MAPT 964/4885MAPK1 382/4885

“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.