SCHEMBL6524929

SCHEMBL6524929

CS(=O)(=O)Nc1ccc2c(c1)/C(=C\c1ccc3[nH]nnc3c1)C(=O)N2

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 3/20 0.57
GSK3B P49841 7/20 0.45
APP P05067 1/20 0.45
MAPT P10636 1/20 0.45
PSEN1 P49768 1/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44
NCSTN Q92542 1/20 0.44
APH1A Q96BI3 1/20 0.44
PSENEN Q9NZ42 1/20 0.44
LRRK2 Q5S007 1/20 0.43
NOX4 Q9NPH5 1/20 0.43
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40

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
SCHEMBL6524933 1.00 PDPK1 (0.57) PDPK1GSK3BAPPMAPTPSEN1
SCHEMBL12848482 0.92 PDPK1 (0.57) PDPK1GSK3BAPPMAPTPSEN1
SCHEMBL6522169 0.90 PDPK1 (0.46) PDPK1GSK3BAPPMAPTPSEN1
SCHEMBL6522165 0.90 PDPK1 (0.46) PDPK1GSK3BAPPMAPTPSEN1
SCHEMBL6522949 0.84 GSK3B (0.67) PDPK1GSK3BAPPMAPTLRRK2
SCHEMBL6522958 0.84 GSK3B (0.67) PDPK1GSK3BAPPMAPTLRRK2
SCHEMBL12848510 0.82 PDPK1 (0.46) PDPK1GSK3BAPPMAPTPSEN1
SCHEMBL6524884 0.82 SRC (0.51) APPMAPT
SCHEMBL6524883 0.82 SRC (0.51) APPMAPT
SCHEMBL12848623 0.82 SRC (0.51) APPMAPT

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 2 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

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 PDPK1 246/4885GSK3B 621/4885APP 4843/4885

“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.