SCHEMBL4381668

SCHEMBL4381668

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

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 11/20 0.60
CDK2 P24941 3/20 0.60
CDK1 P06493 2/20 0.60
GSK3A P49840 4/20 0.45
MAPK1 P28482 6/20 0.41
HDAC6 Q9UBN7 2/20 0.41
AURKA O14965 1/20 0.39
RPS6KA5 O75582 1/20 0.39
DRD1 P21728 1/20 0.39
FLT3 P36888 1/20 0.39
RPS6KA3 P51812 1/20 0.39
PRKAA2 P54646 1/20 0.39
ABAT P80404 1/20 0.39
PRKAA1 Q13131 1/20 0.39
RPS6KA2 Q15349 1/20 0.39
RPS6KA1 Q15418 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
RPS6KA6 Q9UK32 1/20 0.39
STK24 Q9Y6E0 1/20 0.39

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
SCHEMBL4392816 0.88 GSK3B (0.61) GSK3BCDK2CDK1GSK3AMAPK1
SCHEMBL2332408 0.86 GSK3B (0.60) GSK3BCDK2CDK1GSK3AMAPK1
SCHEMBL1461697 0.86 GSK3B (0.82) GSK3BCDK2CDK1GSK3AMAPK1
SCHEMBL2333341 0.84 GSK3B (0.53) GSK3BCDK2CDK1GSK3AMAPK1
SCHEMBL1377235 0.83 GSK3B (0.52) GSK3BCDK2CDK1GSK3A
SCHEMBL2334015 0.81 GSK3B (0.50) GSK3BCDK2CDK1GSK3AMAPK1
SCHEMBL2338792 0.80 GSK3B (0.49) GSK3BCDK2CDK1GSK3AMAPK1
SCHEMBL2331113 0.79 GSK3B (0.73) GSK3BCDK2CDK1GSK3AMAPK1
SCHEMBL2339971 0.77 GSK3B (0.70) GSK3BCDK2CDK1MAPK1
SCHEMBL2337608 0.76 GSK3B (0.49) GSK3BCDK2CDK1GSK3ADRD1

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 159/4885CDK2 549/4885CDK1 63/4885
US-20040132794-A1 Novel aminoindazole derivatives as medicaments and pharmaceutical compositions including them SIGMAR1, CYP2C8, CNR1 GSK3B 3595/4885CDK2 2237/4885CDK1 2123/4885
US-20070155735-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM CNR1, SUCNR1, CBR1 GSK3B 3542/4885CDK2 1855/4885CDK1 1006/4885
US-20060074122-A1 Novel aminoindazole derivatives as medicaments and pharmaceutical compositions including them CNR1, SUCNR1, CBR1 GSK3B 3542/4885CDK2 1855/4885CDK1 1006/4885

“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.