SCHEMBL6480266

SCHEMBL6480266

C/C=C/C(=O)Nc1n[nH]c2ccc(C)cc12

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FADS1 O60427 1/20 0.45
MAP2K4 P45985 5/20 0.45
MAPK1 P28482 3/20 0.45
MAPKAPK3 Q16644 3/20 0.45
MAPK6 Q16659 3/20 0.45
MAPKAPK2 P49137 2/20 0.44
MAPKAPK5 Q8IW41 2/20 0.44
CDK7 P50613 1/20 0.43
GSK3B P49841 4/20 0.43
GSK3A P49840 1/20 0.43
CYP1A2 P05177 1/20 0.41
NTRK1 P04629 3/20 0.41
CDK2 P24941 2/20 0.41
CDK1 P06493 1/20 0.41
CDK4 P11802 1/20 0.41
DYRK1A Q13627 1/20 0.40
MAP2K7 O14733 1/20 0.40
ITK Q08881 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
SCHEMBL6480270 1.00 FADS1 (0.45) FADS1MAP2K4MAPK1MAPKAPK3MAPK6
SCHEMBL15484445 1.00 FADS1 (0.45) FADS1MAP2K4MAPK1MAPKAPK3MAPK6
SCHEMBL15484243 0.82 GSK3B (0.53) FADS1MAP2K4MAPK1MAPKAPK3MAPK6
SCHEMBL1461489 0.82 GSK3B (0.53) FADS1MAP2K4MAPK1MAPKAPK3MAPK6
SCHEMBL1461487 0.82 GSK3B (0.53) FADS1MAP2K4MAPK1MAPKAPK3MAPK6
SCHEMBL6478923 0.77 DYRK1A (0.69) GSK3BDYRK1A
SCHEMBL6485798 0.77 GSK3B (0.63) MAP2K4GSK3BDYRK1A
SCHEMBL15484452 0.77 DYRK1A (0.69) GSK3BDYRK1A
SCHEMBL15484433 0.77 GSK3B (0.63) MAP2K4GSK3BDYRK1A
SCHEMBL6478928 0.77 DYRK1A (0.69) GSK3BDYRK1A

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 11 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-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 FADS1 2727/4885MAP2K4 4219/4885MAPK1 3184/4885

“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.