SCHEMBL4486472

SCHEMBL4486472

CC(C)(C)C(=O)Nc1n[nH]c2cc(Br)ccc12

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 4/20 0.76
GSK3B P49841 10/20 0.66
MAPK1 P28482 1/20 0.47
PDPK1 O15530 1/20 0.46
JAK2 O60674 1/20 0.46
IDO1 P14902 1/20 0.44
HDAC6 Q9UBN7 3/20 0.44

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
SCHEMBL17848098 0.86 DYRK1A (0.85) DYRK1AGSK3BPDPK1JAK2IDO1
SCHEMBL4559733 0.82 DYRK1A (0.74) DYRK1AGSK3BPDPK1JAK2IDO1
SCHEMBL4488169 0.81 GSK3B (0.82) DYRK1AGSK3B
SCHEMBL6490286 0.80 GSK3B (1.00) DYRK1AGSK3B
SCHEMBL31061530 0.80 GSK3B (1.00) DYRK1AGSK3B
SCHEMBL15484452 0.78 DYRK1A (0.69) DYRK1AGSK3BPDPK1JAK2IDO1
SCHEMBL6478928 0.78 DYRK1A (0.69) DYRK1AGSK3BPDPK1JAK2IDO1
SCHEMBL6478923 0.78 DYRK1A (0.69) DYRK1AGSK3BPDPK1JAK2IDO1
SCHEMBL17859180 0.78 GSK3B (0.74) DYRK1AGSK3B
SCHEMBL4485939 0.77 FGFR1 (0.67) DYRK1AGSK3BIDO1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506176-B1 AMINOINDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PFIZER ITALIA SRL (IT) 2013-04-24 EP disclosed
US-7632854-B2 Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2009-12-15 US disclosed
US-20060106083-A1 Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PHARMACIA ITALIA S.P.A. (IT) 2006-05-18 US disclosed
EP-1506176-A1 AMINOINDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2005-02-16 EP disclosed
WO-2003097610-A1 AMINOINDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA S.P.A. (IT) 2003-11-27 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-20060106083-A1 Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K15, MAP3K3, MAP3K20 DYRK1A 298/4885GSK3B 96/4885MAPK1 210/4885

“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.