SCHEMBL10203372

SCHEMBL10203372

CCCn1cc(-c2cccc(Cn3ncc4cnc(Nc5cnn(C)c5)nc43)c2)cn1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 9/20 0.53
▸ IGF1R P08069 4/20 0.47
▸ MET P08581 4/20 0.46
▸ JAK2 O60674 10/20 0.44
▸ JAK1 P23458 5/20 0.42
▸ TYK2 P29597 4/20 0.42
▸ STAT3 P40763 2/20 0.42
▸ HDAC6 Q9UBN7 5/20 0.41
▸ HDAC1 Q13547 2/20 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
SCHEMBL15122407 0.94 JAK3 (0.51) JAK3IGF1RMETJAK2JAK1
SCHEMBL10203859 0.92 MET (0.55) JAK3IGF1RMETJAK2JAK1
SCHEMBL15122444 0.92 IGF1R (0.54) JAK3IGF1RMETJAK2JAK1
SCHEMBL10203860 0.89 JAK3 (0.56) JAK3IGF1RMETJAK2JAK1
SCHEMBL15122430 0.88 JAK3 (0.53) JAK3IGF1RMETJAK2JAK1
SCHEMBL10203368 0.86 MET (0.54) JAK3IGF1RMETJAK2JAK1
SCHEMBL12797316 0.85 JAK3 (0.49) JAK3IGF1RMETJAK2JAK1
SCHEMBL10203369 0.83 JAK3 (0.49) JAK3IGF1RMETJAK2JAK1
SCHEMBL12796159 0.83 JAK3 (0.48) JAK3IGF1RMETJAK2JAK1
SCHEMBL12797095 0.82 JAK3 (0.53) JAK3IGF1RMETJAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 JAK3 2/4885IGF1R 2463/4885MET 4178/4885

“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.

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