SCHEMBL4392816

SCHEMBL4392816

O=C(Nc1ccccc1)Nc1n[nH]c2c(F)c(F)c(-c3ccccc3)cc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 9/20 0.61
CDK1 P06493 3/20 0.56
CDK2 P24941 3/20 0.56
MAPK1 P28482 8/20 0.44
GSK3A P49840 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KIT P10721 2/20 0.41
KDR P35968 2/20 0.41
FLT3 P36888 2/20 0.41
PLK4 O00444 1/20 0.41
AURKA O14965 1/20 0.41
JAK2 O60674 1/20 0.41
ROCK2 O75116 1/20 0.41
CHEK2 O96017 1/20 0.41
NTRK1 P04629 1/20 0.41
INSR P06213 1/20 0.41
LCK P06239 1/20 0.41
CSF1R P07333 1/20 0.41
LYN P07948 1/20 0.41

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
SCHEMBL2339971 0.90 GSK3B (0.70) GSK3BCDK1CDK2MAPK1MEN1
SCHEMBL4381668 0.88 GSK3B (0.60) GSK3BCDK1CDK2MAPK1GSK3A
SCHEMBL4384920 0.85 GSK3B (0.67) GSK3BCDK1CDK2KDRMET
SCHEMBL2335118 0.85 GSK3B (0.67) GSK3BCDK1CDK2MAPK1KIT
SCHEMBL2360845 0.83 GSK3B (0.67) GSK3BCDK1CDK2MAPK1MEN1
SCHEMBL4393025 0.82 GSK3B (0.67) GSK3BCDK1CDK2MAPK1GSK3A
SCHEMBL1461697 0.81 GSK3B (0.82) GSK3BCDK1CDK2MAPK1GSK3A
SCHEMBL4380398 0.81 GSK3B (0.62) GSK3BCDK1CDK2KITKDR
SCHEMBL4379033 0.81 GSK3B (0.62) GSK3BCDK1CDK2MAPK1MEN1
SCHEMBL2333341 0.80 GSK3B (0.53) GSK3BCDK1CDK2MAPK1GSK3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629374-B2 Use of aminoindazole derivatives for the inhibition of tau phosphorylation AVENTIS PHARMA SA (FR) 2009-12-08 US disclosed
US-20080261997-A1 USE OF AMINOINDAZOLE DERIVATIVES FOR THE INHIBITION OF TAU PHOSPHORYLATION AVENTIS PHARMA S.A. (FR) 2008-10-23 US disclosed
US-7407981-B2 Aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA S.A. (FR) 2008-08-05 US disclosed
US-20070155735-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM AVENTIS PHARMA S.A. (FR) 2007-07-05 US disclosed
US-7196109-B2 Aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA SA (FR) 2007-03-27 US disclosed
US-20060074122-A1 Novel aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA S.A. (FR) 2006-04-06 US disclosed
US-7019011-B2 Aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA S.A. (FR) 2006-03-28 US disclosed
US-20040132794-A1 Novel aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA S.A. (FR) 2004-07-08 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 (4 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-20080261997-A1 USE OF AMINOINDAZOLE DERIVATIVES FOR THE INHIBITION OF TAU PHOSPHORYLATION OXSR1, CBR1, OXER1 GSK3B 159/4885CDK1 63/4885CDK2 549/4885
US-20040132794-A1 Novel aminoindazole derivatives as medicaments and pharmaceutical compositions including them SIGMAR1, CYP2C8, CNR1 GSK3B 3595/4885CDK1 2123/4885CDK2 2237/4885
US-20070155735-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM CNR1, SUCNR1, CBR1 GSK3B 3542/4885CDK1 1006/4885CDK2 1855/4885
US-20060074122-A1 Novel aminoindazole derivatives as medicaments and pharmaceutical compositions including them CNR1, SUCNR1, CBR1 GSK3B 3542/4885CDK1 1006/4885CDK2 1855/4885

“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.