SCHEMBL6522938

SCHEMBL6522938

O=C1Nc2ccccc2/C1=C\c1ccc2[nH]nnc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.54
PLK4 O00444 2/20 0.54
PLK1 P53350 2/20 0.54
RET P07949 1/20 0.54
FLT3 P36888 1/20 0.54
KDR P35968 1/20 0.54
ERBB2 P04626 3/20 0.52
MAPT P10636 4/20 0.51
MAPK1 P28482 3/20 0.51
APP P05067 3/20 0.51
SNCA P37840 3/20 0.51
MEN1 O00255 2/20 0.51
ALDH1A1 P00352 2/20 0.51
KMT2A Q03164 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
CTRC Q99895 2/20 0.51
EGFR P00533 2/20 0.51
IGF1R P08069 2/20 0.51
NPC1 O15118 1/20 0.51
GMNN O75496 1/20 0.51

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
SCHEMBL6522946 1.00 PDGFRB (0.54) PDGFRBPLK4PLK1RETFLT3
SCHEMBL12794839 0.90 PDGFRB (0.54) PDGFRBPLK4PLK1RETFLT3
SCHEMBL6525491 0.85 RET (0.57) PLK4RETFLT3PIM1PSEN1
SCHEMBL6525485 0.85 RET (0.57) PLK4RETFLT3PIM1PSEN1
SCHEMBL6522510 0.85 PLK4 (0.61) PDGFRBPLK4PLK1RETKDR
SCHEMBL6522514 0.85 PLK4 (0.61) PDGFRBPLK4PLK1RETKDR
SCHEMBL6523868 0.84 MGAM (0.52) ERBB2EGFRPSEN1PSEN2APH1B
SCHEMBL6523877 0.84 MGAM (0.52) ERBB2EGFRPSEN1PSEN2APH1B
SCHEMBL6528268 0.80 PDGFRB (0.54) PDGFRBPLK4PLK1RETFLT3
SCHEMBL6528272 0.80 PDGFRB (0.54) PDGFRBPLK4PLK1RETFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9402828-B2 Methods of targeting PTEN mutant diseases and compositions therefor UNIVERSITY HEALTH NETWORK (CA) 2016-08-02 US disclosed
US-9402828-B2 Methods of targeting PTEN mutant diseases and compositions therefor UNIVERSITY HEALTH NETWORK (CA) 2016-08-02 US disclosed
US-20150182504-A1 METHODS OF TARGETING PTEN MUTANT DISEASES AND COMPOSITIONS THEREFOR UNIVERSITY HEALTH NETWORK (CA) 2015-07-02 US disclosed
US-20150182504-A1 METHODS OF TARGETING PTEN MUTANT DISEASES AND COMPOSITIONS THEREFOR UNIVERSITY HEALTH NETWORK (CA) 2015-07-02 US disclosed
US-8933070-B2 Methods of targeting PTEN mutant diseases and compositions therefor UNIVERSITY HEALTH NETWORK (CA) 2015-01-13 US disclosed
US-8933070-B2 Methods of targeting PTEN mutant diseases and compositions therefor UNIVERSITY HEALTH NETWORK (CA) 2015-01-13 US disclosed
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-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-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-20130123273-A1 METHODS OF TARGETING PTEN MUTANT DISEASES AND COMPOSITIONS THEREFOR UNIVERSITY HEALTH NETWORK (CA) 2013-05-16 US disclosed
US-20130123273-A1 METHODS OF TARGETING PTEN MUTANT DISEASES AND COMPOSITIONS THEREFOR UNIVERSITY HEALTH NETWORK (CA) 2013-05-16 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
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
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 (3 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-20130123273-A1 METHODS OF TARGETING PTEN MUTANT DISEASES AND COMPOSITIONS THEREFOR PTEN, PIK3CA, HRAS PDGFRB 277/4885PLK4 23/4885PLK1 30/4885
US-20110065702-A1 INDAZOLYL, BENZIMIDAZOLYL, BENZOTRIAZOLYL SUBSTITUTED INDOLINONE DERIVATIVES AS KINASE INHIBITORS USEFUL IN THE TREATMENT OF CANCER TNNI3K, ABL1, TK1 PDGFRB 692/4885PLK4 464/4885PLK1 4/4885
US-20150182504-A1 METHODS OF TARGETING PTEN MUTANT DISEASES AND COMPOSITIONS THEREFOR PTEN, PIK3CA, HRAS PDGFRB 151/4885PLK4 139/4885PLK1 46/4885

“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.