SCHEMBL859958

SCHEMBL859958

CN1CCN(c2ccc(Nc3ccn4ncc(C=C5NC(=O)NC5=O)c4n3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 4/20 0.45
TNK2 Q07912 2/20 0.42
FYN P06241 1/20 0.41
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
JAK2 O60674 3/20 0.39
DYRK3 O43781 4/20 0.38
CLK1 P49759 4/20 0.38
CLK2 P49760 4/20 0.38
CLK3 P49761 4/20 0.38
GSK3B P49841 4/20 0.38
DYRK1A Q13627 4/20 0.38
DYRK2 Q92630 4/20 0.38
CLK4 Q9HAZ1 4/20 0.38
DYRK1B Q9Y463 4/20 0.38
JAK3 P52333 1/20 0.38
PTK2 Q05397 1/20 0.38
BRD4 O60885 1/20 0.38

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
SCHEMBL859957 1.00 FLT3 (0.45) FLT3TNK2FYNKDM4EALDH1A1
SCHEMBL12979069 1.00 FLT3 (0.45) FLT3TNK2FYNKDM4EALDH1A1
SCHEMBL860849 0.90 JAK2 (0.40) KDM4EALDH1A1MAPTJAK2JAK3
SCHEMBL12979143 0.90 JAK2 (0.40) KDM4EALDH1A1MAPTJAK2JAK3
SCHEMBL860848 0.90 JAK2 (0.40) KDM4EALDH1A1MAPTJAK2JAK3
SCHEMBL14679089 0.87 FLT3 (0.45) FLT3TNK2FYNJAK2DYRK3
SCHEMBL12979564 0.83 GSK3B (0.42) FYNKDM4EALDH1A1MAPTGAA
SCHEMBL860452 0.83 GSK3B (0.42) FYNKDM4EALDH1A1MAPTGAA
SCHEMBL860453 0.83 GSK3B (0.42) FYNKDM4EALDH1A1MAPTGAA
SCHEMBL860721 0.83 FLT3 (0.50) FLT3FYNALDH1A1JAK2JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367681-B2 Pyrazolopyrimidines and related heterocycles as kinase inhibitors CYLENE PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
EP-2432473-A1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS Cylene Pharmaceuticals, Inc. (US) 2012-03-28 EP disclosed
US-20100331314-A1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS SENHWA BIOSCIENCES, INC. (TW) 2010-12-30 US disclosed
WO-2010135581-A1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS CYLENE PHARMACEUTICALS, INC. (US) 2010-11-25 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-20100331314-A1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS PIM1, PIM2, PIM3 FLT3 39/4885TNK2 236/4885FYN 162/4885

“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.