SCHEMBL1461649

SCHEMBL1461649

O=C(Nc1n[nH]c2cc(Cl)ccc12)c1cccnc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK7 P50613 1/20 0.56
KCNMA1 Q12791 1/20 0.56
HDAC6 Q9UBN7 5/20 0.56
GSK3B P49841 3/20 0.55
MAPK1 P28482 2/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
FGFR1 P11362 1/20 0.52
FGFR2 P21802 1/20 0.52
FGFR3 P22607 1/20 0.52
HPGD P15428 1/20 0.51
CYP1A2 P05177 1/20 0.50
IKBKB O14920 1/20 0.50
CHUK O15111 1/20 0.50
ICOSLG O75144 1/20 0.50
PIM1 P11309 1/20 0.50
PIM3 Q86V86 1/20 0.50
IKBKG Q9Y6K9 1/20 0.50
ICOS Q9Y6W8 1/20 0.50

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
SCHEMBL6491066 0.86 FGFR1 (0.67) CDK7HDAC6GSK3BFGFR1FGFR2
SCHEMBL1461326 0.85 HDAC6 (0.66) CDK7KCNMA1HDAC6GSK3BFGFR1
SCHEMBL1461452 0.83 HDAC6 (0.75) HDAC6GSK3BFGFR1FGFR2FGFR3
SCHEMBL1461259 0.82 HDAC6 (0.65) HDAC6GSK3BFGFR1FGFR2FGFR3
SCHEMBL6478970 0.81 GSK3B (0.61) GSK3BKMT2ACYP1A2
SCHEMBL6479762 0.79 GSK3B (0.58) HDAC6GSK3BMAPK1FGFR1FGFR2
SCHEMBL1461238 0.77 HDAC6 (0.57) HDAC6GSK3BFGFR1FGFR2FGFR3
SCHEMBL1460219 0.75 GSK3B (0.71) HDAC6GSK3B
SCHEMBL1461648 0.75 GSK3B (0.56) KCNMA1HDAC6GSK3BMAPK1MEN1
SCHEMBL1461477 0.75 GSK3B (0.56) KCNMA1HDAC6GSK3BMAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487804-B1 AMINOINDAZOLE DERIVATIVES AS PROTEIN-KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2014-02-26 EP claimed
JP-4648630-B2 2011-03-09 JP claimed
JP-2005530711-A 2005-10-13 JP claimed
US-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US claimed
EP-1487804-A2 AMINOINDAZOLE DERIVATIVES AS PROTEIN-KINASE INHIBITORS Aventis Pharma S.A. (FR) 2004-12-22 EP claimed
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 US claimed
WO-2003078403-A2 DERIVES D’AMINOINDAZOLES COMME INHIBITEURS DE PROTEINE-KINASE AVENTIS PHARMA S.A. (FR) 2003-09-25 WO claimed
EP-1487804-B1 AMINOINDAZOLE DERIVATIVES AS PROTEIN-KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2014-02-26 EP disclosed
US-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US disclosed
EP-1487804-A2 AMINOINDAZOLE DERIVATIVES AS PROTEIN-KINASE INHIBITORS Aventis Pharma S.A. (FR) 2004-12-22 EP disclosed
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 US disclosed
WO-2003078403-A2 DERIVES D’AMINOINDAZOLES COMME INHIBITEURS DE PROTEINE-KINASE AVENTIS PHARMA S.A. (FR) 2003-09-25 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-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof CYP2C8, NR0B2, NR2C2 CDK7 657/4885KCNMA1 3880/4885HDAC6 1699/4885

“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.