SCHEMBL12801973

SCHEMBL12801973

NS(=O)(=O)c1ccc(-n2ncc3cnc(Nc4cnn(CCO)c4)nc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 2/20 0.55
JAK2 O60674 13/20 0.47
HDAC6 Q9UBN7 7/20 0.47
JAK3 P52333 9/20 0.44
JAK1 P23458 6/20 0.43
KDR P35968 1/20 0.41
AURKB Q96GD4 1/20 0.41
CDK1 P06493 2/20 0.41
CDK2 P24941 2/20 0.41
CDK9 P50750 2/20 0.41
TYK2 P29597 1/20 0.41
HDAC1 Q13547 1/20 0.41
CCNT1 O60563 1/20 0.41
CCNB2 O95067 1/20 0.41
CCNE2 O96020 1/20 0.41
CCNB1 P14635 1/20 0.41
CCNE1 P24864 1/20 0.41
CDK5 Q00535 1/20 0.41
CDK5R1 Q15078 1/20 0.41
CCNB3 Q8WWL7 1/20 0.41

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
SCHEMBL12801980 0.86 EIF2AK4 (0.54) EIF2AK4JAK2HDAC6JAK3KDR
SCHEMBL12801913 0.85 CDK9 (0.53) EIF2AK4JAK2JAK3JAK1CDK1
SCHEMBL12797139 0.77 EIF2AK4 (0.48) EIF2AK4JAK2HDAC6JAK3JAK1
SCHEMBL16782491 0.77 JAK3 (0.61) JAK2JAK3JAK1KDRAURKB
SCHEMBL12802007 0.76 EIF2AK4 (0.53) EIF2AK4JAK2HDAC6JAK3JAK1
SCHEMBL16782531 0.75 JAK3 (0.57) JAK2JAK3JAK1TYK2
SCHEMBL16782656 0.75 JAK3 (0.57) JAK2JAK3JAK1AURKBCDK1
SCHEMBL12797028 0.74 EIF2AK4 (0.51) EIF2AK4JAK2HDAC6JAK3JAK1
SCHEMBL15148927 0.74 EIF2AK4 (0.56) EIF2AK4JAK2HDAC6JAK3KDR
SCHEMBL1662594 0.74 CDK2 (0.54) EIF2AK4JAK2JAK3JAK1KDR

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-9242987-B2 Heterocyclyl pyrazolopyrimidine analogues as JAK inhibitors CELLZOME LIMITED (GB) 2016-01-26 US claimed
US-20120252779-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS CELLZOME LIMITED (GB) 2012-10-04 US claimed
CN-102666545-A Heterocyclyl pyrazolopyrimidine analogues as jak inhibitors CELLZOME LTD 2012-09-12 CN claimed
US-9242987-B2 Heterocyclyl pyrazolopyrimidine analogues as JAK inhibitors CELLZOME LIMITED (GB) 2016-01-26 US disclosed
US-9242987-B2 Heterocyclyl pyrazolopyrimidine analogues as JAK inhibitors CELLZOME LIMITED (GB) 2016-01-26 US disclosed
US-9242987-B2 Heterocyclyl pyrazolopyrimidine analogues as JAK inhibitors CELLZOME LIMITED (GB) 2016-01-26 US disclosed
US-20120252779-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS CELLZOME LIMITED (GB) 2012-10-04 US disclosed
US-20120252779-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS CELLZOME LIMITED (GB) 2012-10-04 US disclosed
US-20120252779-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS CELLZOME LIMITED (GB) 2012-10-04 US disclosed
CN-102666545-A Heterocyclyl pyrazolopyrimidine analogues as jak inhibitors CELLZOME LTD 2012-09-12 CN 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-20120252779-A1 HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS JAK1, JAK3, JAK2 EIF2AK4 1347/4885JAK2 3/4885HDAC6 1292/4885

“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.