SCHEMBL6478176

SCHEMBL6478176

Nc1n[nH]c2cc(-c3ccc(O)cc3)c(-c3ccco3)cc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 6/20 0.61
ADORA2A P29274 1/20 0.48
ADORA2B P29275 1/20 0.48
ADORA1 P30542 1/20 0.48
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
FGFR1 P11362 2/20 0.41
FGFR2 P21802 2/20 0.41
PDPK1 O15530 2/20 0.40
HSP90AB1 P08238 1/20 0.40
SGK1 O00141 1/20 0.40
JAK2 O60674 3/20 0.40
FGFR3 P22607 1/20 0.40
EGFR P00533 1/20 0.39
MAPK14 Q16539 1/20 0.39
CDK2 P24941 1/20 0.39
GSK3A P49840 1/20 0.39
SMARCA2 P51531 1/20 0.39
PBRM1 Q86U86 1/20 0.39
CHEK1 O14757 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
SCHEMBL6489615 0.85 PDPK1 (0.53) GSK3BFGFR1FGFR2PDPK1HSP90AB1
SCHEMBL6479380 0.83 JAK2 (0.58) GSK3BFGFR1FGFR2PDPK1HSP90AB1
SCHEMBL6479422 0.81 IKBKE (0.48) GSK3BADORA2AJAK2CDK2
SCHEMBL6490350 0.77 GSK3B (0.60) GSK3BFGFR1FGFR2PDPK1HSP90AB1
SCHEMBL1461708 0.77 GSK3B (1.00) GSK3BCDK2
SCHEMBL1180049 0.76 JAK2 (0.59) GSK3BPDPK1JAK2CDK2GSK3A
SCHEMBL6486529 0.75 GSK3B (0.63) GSK3BFGFR1FGFR2PDPK1HSP90AB1
SCHEMBL6477985 0.74 GSK3B (0.56) GSK3BFGFR1FGFR2PDPK1HSP90AB1
SCHEMBL6479743 0.74 CDK2 (0.59) GSK3BFGFR1FGFR2PDPK1HSP90AB1
SCHEMBL6478798 0.73 JAK2 (0.64) GSK3BFGFR1PDPK1JAK2GSK3A

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 9 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
CN-101962365-A Aminoindazole derivatives as protein-kinase inhibitors AVENTIS PHARMA SA 2011-02-02 CN 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 (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 GSK3B 2342/4885ADORA2A 369/4885ADORA2B 375/4885

“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.