SCHEMBL4287617

SCHEMBL4287617

CC(=O)Nc1ccc(-c2ccnc(Nc3cnccc3N3C[C@@H]4C[C@H]3CN4C)n2)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 10/20 0.41
ABL1 P00519 5/20 0.41
BCR P11274 5/20 0.41
PDGFRB P09619 2/20 0.41
PDGFRA P16234 2/20 0.41
JAK3 P52333 2/20 0.41
WNT1 P04628 1/20 0.40
GSK3B P49841 1/20 0.40
DYRK1A Q13627 1/20 0.40
IKBKB O14920 1/20 0.37
CHUK O15111 1/20 0.37
TYK2 P29597 3/20 0.37
KIT P10721 2/20 0.37
JAK1 P23458 1/20 0.37
PLK4 O00444 1/20 0.36
DDX3X O00571 1/20 0.36
GAK O14976 1/20 0.36
SLC22A2 O15244 1/20 0.36
MAPK13 O15264 1/20 0.36
CA12 O43570 1/20 0.36

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
SCHEMBL4281990 1.00 JAK2 (0.41) JAK2ABL1BCRPDGFRBPDGFRA
SCHEMBL4290885 0.85 JAK2 (0.44) JAK2ABL1BCRPDGFRBPDGFRA
SCHEMBL4281637 0.85 JAK2 (0.44) JAK2ABL1BCRPDGFRBPDGFRA
SCHEMBL4284072 0.85 CHRNA7 (0.46) JAK2JAK3WNT1GSK3BDYRK1A
SCHEMBL4287608 0.83 CHRNA7 (0.37) ABL1BCRJAK3TYK2JAK1
SCHEMBL4287078 0.83 JAK2 (0.42) JAK2ABL1BCRPDGFRBPDGFRA
SCHEMBL4279789 0.83 JAK2 (0.42) JAK2ABL1BCRPDGFRBPDGFRA
SCHEMBL4277039 0.75 PAK1 (0.42) JAK2ABL1BCRJAK3WNT1
SCHEMBL4278009 0.75 PAK1 (0.42) JAK2ABL1BCRJAK3WNT1
SCHEMBL4282107 0.75 TYK2 (0.46) JAK2ABL1BCRPDGFRBPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9624229-B2 Pyrimidine-2-amine compounds and their use as inhibitors of JAK kinases RIGEL PHARMACEUTICALS, INC. (US) 2017-04-18 US disclosed
EP-2265607-B1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES RIGEL PHARMACEUTICALS INC (US) 2016-12-14 EP disclosed
US-20140213585-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES RIGEL PHARMACEUTICALS, INC. (US) 2014-07-31 US disclosed
US-8735418-B2 Pyrimidine-2-amine compounds and their use as inhibitors of JAK kinases RIGEL PHARMACEUTICALS, INC. (US) 2014-05-27 US disclosed
US-20130310340-A1 METHOD OF TREATING MUSCULAR DEGRADATION RIGEL PHARMACEUTICALS, INC. (US) 2013-11-21 US disclosed
US-20130018041-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES RIGEL PHARMACEUTICAL, INC. (US) 2013-01-17 US disclosed
US-8309566-B2 Pyrimidine-2-amine compounds and their use as inhibitors of JAK kinases RIGEL PHARMACEUTICALS, INC. (US) 2012-11-13 US disclosed
US-20090258864-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES RIGEL PHARMACEUTICALS, INC. (US) 2009-10-15 US 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 (4 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-20130310340-A1 METHOD OF TREATING MUSCULAR DEGRADATION PYGM, CKMT1A; CKMT1B, SMN1; SMN2 JAK2 4729/4885ABL1 4030/4885BCR 4805/4885
US-20140213585-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES JAK2, JAK1, JAK3 JAK2 1/4885ABL1 9/4885BCR 1684/4885
US-20130018041-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES JAK2, JAK1, JAK3 JAK2 1/4885ABL1 5/4885BCR 1519/4885
US-20090258864-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES JAK2, JAK1, JAK3 JAK2 1/4885ABL1 5/4885BCR 1663/4885

“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.