SCHEMBL4281316

SCHEMBL4281316

CC(=O)Nc1ccc(-c2ccnc(Nc3ccc(N4C[C@@H]5C[C@H]4CO5)c(C)c3)n2)cn1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 2/20 0.48
MYLK4 Q86YV6 1/20 0.45
CLK4 Q9HAZ1 1/20 0.45
JAK2 O60674 10/20 0.43
JAK3 P52333 2/20 0.42
ABL1 P00519 1/20 0.42
PDGFRB P09619 1/20 0.42
BCR P11274 1/20 0.42
PDGFRA P16234 1/20 0.42
JAK1 P23458 1/20 0.42
TYK2 P29597 1/20 0.42
SYK P43405 1/20 0.40
WNT1 P04628 4/20 0.39
GSK3B P49841 4/20 0.39
DYRK1A Q13627 4/20 0.39
PLK1 P53350 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
SCHEMBL4284312 1.00 STK17A (0.48) STK17AMYLK4CLK4JAK2JAK3
SCHEMBL4286106 0.87 STK17A (0.48) STK17AMYLK4CLK4SYK
SCHEMBL4276690 0.87 STK17A (0.48) STK17AMYLK4CLK4SYK
SCHEMBL4281898 0.87 STK17A (0.45) STK17AMYLK4CLK4JAK2JAK3
SCHEMBL4280962 0.87 STK17A (0.45) STK17AMYLK4CLK4JAK2JAK3
SCHEMBL4281637 0.86 JAK2 (0.44) JAK2JAK3ABL1PDGFRBBCR
SCHEMBL4290885 0.86 JAK2 (0.44) JAK2JAK3ABL1PDGFRBBCR
SCHEMBL4277895 0.84 STK17A (0.46) STK17AMYLK4CLK4JAK2JAK3
SCHEMBL4286607 0.84 STK17A (0.46) STK17AMYLK4CLK4JAK2JAK3
SCHEMBL4278271 0.82 STK17A (0.45) STK17AMYLK4CLK4JAK2JAK3

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-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-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 (3 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-20140213585-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES JAK2, JAK1, JAK3 STK17A 247/4885MYLK4 1575/4885CLK4 1184/4885
US-20130018041-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES JAK2, JAK1, JAK3 STK17A 213/4885MYLK4 1855/4885CLK4 699/4885
US-20090258864-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES JAK2, JAK1, JAK3 STK17A 229/4885MYLK4 1872/4885CLK4 689/4885

“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.