SCHEMBL2938519

SCHEMBL2938519

Cc1cnc2c(-c3cc(N4CCCC(C(N)=O)C4)ncn3)c(N)nn2c1

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 19/20 0.79
▸ JAK3 P52333 19/20 0.79
▸ ITGB2 P05107 1/20 0.42
▸ ICAM1 P05362 1/20 0.42
▸ ITGAL P20701 1/20 0.42

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
SCHEMBL13842341 0.90 JAK2 (0.72) JAK2JAK3
SCHEMBL13842332 0.89 JAK2 (0.71) JAK2JAK3
SCHEMBL13842328 0.88 JAK2 (1.00) JAK2JAK3ITGB2ICAM1ITGAL
SCHEMBL13842331 0.87 JAK2 (0.71) JAK2JAK3
SCHEMBL13842329 0.86 JAK2 (0.68) JAK2JAK3
SCHEMBL13842330 0.85 JAK2 (0.70) JAK2JAK3
SCHEMBL13178258 0.84 JAK2 (0.67) JAK2JAK3
SCHEMBL13842589 0.84 JAK2 (0.59) JAK2JAK3ITGB2ICAM1ITGAL
SCHEMBL13842260 0.82 JAK2 (0.67) JAK2JAK3
SCHEMBL13842340 0.80 JAK2 (0.85) JAK2JAK3ITGB2ICAM1ITGAL

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
EP-1812440-B1 PYRAZOLO[1,5-A]PYRIMIDINES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMA (US) 2010-09-22 — — EP disclosed
US-7528138-B2 Pyrazolo[1,5-a]pyrimidines useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-05-05 — — US disclosed
US-7528138-B2 Pyrazolo[1,5-a]pyrimidines useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-05-05 — — US disclosed
US-7528138-B2 Pyrazolo[1,5-a]pyrimidines useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-05-05 — — US disclosed
EP-1812440-A1 PYRAZOLOÝ1,5-a¨PYRIMIDINES USEFUL AS INHIBITORS OF PROTEIN KINASES Vertex Pharmaceuticals, Inc. (US) 2007-08-01 — — EP disclosed
US-20060135537-A1 Pyrazolo[1,5-a]pyrimidines useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED 2006-06-22 — — US disclosed
WO-2006052913-A1 PYRAZOLO[1,5-a]PYRIMIDINES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2006-05-18 — — 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-20060135537-A1 Pyrazolo[1,5-a]pyrimidines useful as inhibitors of protein kinases MAP3K5, MAP3K20, MAP3K1 JAK2 160/4885JAK3 188/4885ITGB2 4474/4885

“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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