SCHEMBL4493264

SCHEMBL4493264

CC(C)NC(=O)Nc1n[nH]c2cc(-c3ccc(CO)cc3)ccc12

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 17/20 0.53
MAPK1 P28482 1/20 0.48
CYP1A2 P05177 1/20 0.48
GSK3A P49840 2/20 0.48
PIK3CD O00329 1/20 0.48
PIM1 P11309 1/20 0.48
CDK2 P24941 1/20 0.48
AAK1 Q2M2I8 1/20 0.48
FGFR1 P11362 1/20 0.47
FGFR2 P21802 1/20 0.47
FGFR3 P22607 1/20 0.47

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
SCHEMBL4485338 0.85 GSK3B (0.57) GSK3BCYP1A2
SCHEMBL4503677 0.84 HDAC6 (0.65) GSK3BMAPK1
SCHEMBL4485356 0.83 GSK3B (0.57) GSK3BCYP1A2
SCHEMBL4496605 0.78 HDAC6 (0.64) GSK3BMAPK1CYP1A2GSK3APIM1
SCHEMBL4486390 0.75 GSK3B (0.62) GSK3BCYP1A2GSK3APIK3CDPIM1
SCHEMBL12886215 0.73 GSK3B (0.55) GSK3BCYP1A2
SCHEMBL6485745 0.73 GSK3B (0.80) GSK3BCYP1A2
SCHEMBL4483419 0.73 HDAC6 (0.61) GSK3B
SCHEMBL4494393 0.72 GSK3B (0.68) GSK3BMAPK1GSK3APIK3CDPIM1
SCHEMBL4477055 0.72 GSK3B (0.65) GSK3BGSK3APIK3CDPIM1CDK2

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 3 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

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 GSK3B 96/4885MAPK1 210/4885CYP1A2 3770/4885

“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.