SCHEMBL16795290

SCHEMBL16795290

Fc1c(Cl)nc(-c2cnn3ccccc23)nc1Cl

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.47
JAK2 O60674 17/20 0.42
JAK1 P23458 16/20 0.42
JAK3 P52333 16/20 0.42
CCNK O75909 1/20 0.40
CDK12 Q9NYV4 1/20 0.40
EPHB3 P54753 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
SCHEMBL16795294 0.85 DYRK1A (0.50) DYRK1AJAK2JAK1JAK3CCNK
SCHEMBL18302116 0.82 JAK2 (0.54) JAK2JAK1JAK3
SCHEMBL2342714 0.82 DYRK1A (0.47) DYRK1AJAK2JAK1JAK3CCNK
SCHEMBL16795169 0.82 DYRK1A (0.47) DYRK1AJAK2JAK1JAK3CCNK
SCHEMBL18302112 0.81 DYRK1A (0.49) DYRK1AJAK2JAK1JAK3CCNK
SCHEMBL30060574 0.81 CYP11B1 (0.33) JAK2JAK1JAK3
SCHEMBL16795132 0.78 JAK2 (0.40) DYRK1AJAK2JAK1JAK3EPHB3
SCHEMBL18302420 0.78 JAK2 (0.70) DYRK1AJAK2JAK1JAK3
SCHEMBL20240136 0.78 JAK2 (0.70) DYRK1AJAK2JAK1JAK3
SCHEMBL16795293 0.77 CCNT1 (0.61) JAK2JAK1JAK3CCNKCDK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759793-B2 2-(pyrazolopyridin-3-yl)pyrimidine derivatives as JAK inhibitors ALMIRALL, S.A. (ES) 2020-09-01 US disclosed
US-20180162856-A1 2-(PYRAZOLOPYRIDIN-3-YL)PYRIMIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2018-06-14 US disclosed
EP-3307272-A1 2-(PYRAZOLOPYRIDIN-3-YL)PYRIMIDINE DERIVATIVES AS JAK INHIBITORS Almirall, S.A. (ES) 2018-04-18 EP disclosed
WO-2016198663-A1 2-(PYRAZOLOPYRIDIN-3-YL)PYRIMIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2016-12-15 WO disclosed
WO-2015086693-A1 PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2015-06-18 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 (2 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-20180162856-A1 2-(PYRAZOLOPYRIDIN-3-YL)PYRIMIDINE DERIVATIVES AS JAK INHIBITORS JAK2, JAK3, JAK1 DYRK1A 443/4885JAK2 1/4885JAK1 3/4885
US-10759793-B2 2-(pyrazolopyridin-3-yl)pyrimidine derivatives as JAK inhibitors JAK2, JAK3, JAK1 DYRK1A 443/4885JAK2 1/4885JAK1 3/4885

“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.