SCHEMBL671582

SCHEMBL671582

Cn1cc(Nc2ncc3cnn(Cc4cccc(N5CCOCC5)c4Cl)c3n2)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 5/20 0.41
JAK3 P52333 5/20 0.41
JAK1 P23458 4/20 0.41
TYK2 P29597 4/20 0.41
STAT6 P42226 4/20 0.41
PDGFRB P09619 1/20 0.41
SLC2A1 P11166 1/20 0.41
FGFR1 P11362 1/20 0.41
SRC P12931 1/20 0.41
PDGFRA P16234 1/20 0.41
PKMYT1 Q99640 1/20 0.41
CDK19 Q9BWU1 2/20 0.41
ALK Q9UM73 2/20 0.41
JUN P05412 2/20 0.40
MAPK10 P53779 2/20 0.40
FLT4 P35916 2/20 0.40
KDR P35968 2/20 0.40
MAPK8 P45983 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 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
SCHEMBL1662634 0.91 STAT6 (0.45) JAK2JAK3JAK1TYK2STAT6
SCHEMBL10203357 0.90 JAK3 (0.42) JAK2JAK3JAK1TYK2STAT6
SCHEMBL675912 0.90 STAT6 (0.45) JAK2JAK3JAK1TYK2STAT6
SCHEMBL1665415 0.84 CDK19 (0.50) JAK2JAK3JAK1TYK2CDK19
SCHEMBL672276 0.81 JAK3 (0.42) JAK2JAK3JAK1TYK2STAT6
SCHEMBL1662524 0.81 STAT6 (0.51) JAK2JAK3JAK1STAT6PDGFRB
SCHEMBL12795222 0.80 CDK19 (0.54) JAK2JAK3JAK1TYK2CDK19
SCHEMBL1665162 0.79 STAT6 (0.44) JAK2JAK3JAK1TYK2STAT6
SCHEMBL672453 0.79 STAT6 (0.51) JAK2STAT6PDGFRBSLC2A1FGFR1
SCHEMBL671518 0.79 JAK3 (0.49) JAK2JAK3JAK1TYK2STAT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130190292-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS SELECTIVE JAK INHIBITORS CELLZOME LIMITED (GB) 2013-07-25 US claimed
US-9040545-B2 Heterocyclyl pyrazolopyrimidine analogues as selective JAK inhibitors CELLZOME LIMITED (GB) 2015-05-26 US disclosed
US-9040545-B2 Heterocyclyl pyrazolopyrimidine analogues as selective JAK inhibitors CELLZOME LIMITED (GB) 2015-05-26 US disclosed
US-9040545-B2 Heterocyclyl pyrazolopyrimidine analogues as selective JAK inhibitors CELLZOME LIMITED (GB) 2015-05-26 US disclosed
US-20130190292-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS SELECTIVE JAK INHIBITORS CELLZOME LIMITED (GB) 2013-07-25 US disclosed
US-20130190292-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS SELECTIVE JAK INHIBITORS CELLZOME LIMITED (GB) 2013-07-25 US disclosed
US-20130190292-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS SELECTIVE JAK INHIBITORS CELLZOME LIMITED (GB) 2013-07-25 US disclosed
EP-2606050-A2 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS SELECTIVE JAK INHIBITORS Cellzome Limited (GB) 2013-06-26 EP disclosed
WO-2012022681-A2 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS SELECTIVE JAK INHIBITORS CELLZOME LIMITED (GB) 2012-02-23 WO disclosed
WO-2012022681-A2 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS SELECTIVE JAK INHIBITORS CELLZOME LIMITED (GB) 2012-02-23 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-20130190292-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS SELECTIVE JAK INHIBITORS JAK1, JAK3, JAK2 JAK2 3/4885JAK3 2/4885JAK1 1/4885

“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.