SCHEMBL6492377

SCHEMBL6492377

Nc1n[nH]c2cc(-c3cccnc3)ccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.69
PDPK1 O15530 7/20 0.67
AXL P30530 2/20 0.62
CHEK1 O14757 2/20 0.60
FGFR1 P11362 2/20 0.55
GSK3B P49841 2/20 0.54
CYP1A2 P05177 1/20 0.54
AURKA O14965 3/20 0.54
AURKB Q96GD4 3/20 0.54
TGFBR1 P36897 2/20 0.54
MEN1 O00255 1/20 0.51
PSIP1 O75475 1/20 0.51
MKNK1 Q9BUB5 1/20 0.51
MKNK2 Q9HBH9 1/20 0.51
KDR P35968 2/20 0.51
JAK3 P52333 2/20 0.51
ROCK1 Q13464 2/20 0.51
LRRK2 Q5S007 2/20 0.51
DAPK3 O43293 1/20 0.51
PRKD3 O94806 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
SCHEMBL30588952 0.88 JAK2 (0.69) JAK2AXLCHEK1FGFR1GSK3B
SCHEMBL10213963 0.88 JAK2 (0.69) JAK2AXLCHEK1FGFR1GSK3B
SCHEMBL12907241 0.82 JAK2 (1.00) JAK2PDPK1CHEK1GSK3BAURKA
SCHEMBL3361070 0.82 JAK2 (1.00) JAK2PDPK1CHEK1GSK3BAURKA
SCHEMBL6485242 0.80 PDPK1 (1.00) JAK2PDPK1CHEK1GSK3BAURKA
SCHEMBL12907253 0.79 PDPK1 (1.00) JAK2PDPK1FGFR1AURKAAURKB
SCHEMBL6480460 0.78 PDPK1 (0.65) JAK2PDPK1GSK3BAURKAAURKB
SCHEMBL6490350 0.77 GSK3B (0.60) JAK2PDPK1AXLFGFR1GSK3B
SCHEMBL6371302 0.77 AXL (1.00) PDPK1AXLFGFR1AURKAMEN1
SCHEMBL28871221 0.77 KDR (0.67) JAK2AXLFGFR1GSK3BAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101962365-A Aminoindazole derivatives as protein-kinase inhibitors AVENTIS PHARMA SA 2011-02-02 CN claimed
US-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US claimed
CN-1656078-A Aminoindazole derivatives as protein kinase inhibitors AVENTIS PHARMA SA (FR) 2005-08-17 CN claimed
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 US claimed
EP-1487804-B1 AMINOINDAZOLE DERIVATIVES AS PROTEIN-KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2014-02-26 EP disclosed
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
CN-101962365-A Aminoindazole derivatives as protein-kinase inhibitors AVENTIS PHARMA SA 2011-02-02 CN disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
WO-2007117465-A2 INDAZOLE COMPOUNDS ABBOTT LABORATORIES (US) 2007-10-18 WO disclosed
US-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US disclosed
CN-1656078-A Aminoindazole derivatives as protein kinase inhibitors AVENTIS PHARMA SA (FR) 2005-08-17 CN disclosed
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 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-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof CYP2C8, NR0B2, NR2C2 JAK2 1774/4885PDPK1 4495/4885AXL 329/4885
US-20070282101-A1 Indazole compounds CYP3A43, CYP3A7, UGT1A1 JAK2 1822/4885PDPK1 856/4885AXL 2872/4885
US-20120053345-A1 Indazole Compounds CYP3A43, CYP3A7, UGT1A1 JAK2 1822/4885PDPK1 856/4885AXL 2872/4885

“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.