SCHEMBL4285219

SCHEMBL4285219

CC1(C)Oc2cc(-c3ccnc(Nc4ccc(N5C[C@@H]6C[C@H]5CN6S(C)(=O)=O)c(Cl)c4)n3)cnc2NC1=O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 6/20 0.34
SYK P43405 1/20 0.34
SLC2A1 P11166 1/20 0.33
WEE1 P30291 3/20 0.33
IKBKB O14920 3/20 0.33
CHUK O15111 2/20 0.33
JAK3 P52333 4/20 0.32
JAK2 O60674 3/20 0.32
CDK9 P50750 2/20 0.32
CLK1 P49759 2/20 0.32
DYRK1A Q13627 2/20 0.32
CLK4 Q9HAZ1 2/20 0.32
DYRK1B Q9Y463 2/20 0.32
CLK2 P49760 1/20 0.32
JAK1 P23458 1/20 0.32

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
SCHEMBL4279773 1.00 BRD4 (0.34) BRD4SYKSLC2A1WEE1IKBKB
SCHEMBL4289327 0.93 JAK3 (0.35) BRD4SYKJAK3JAK2CDK9
SCHEMBL4276992 0.93 JAK3 (0.35) BRD4SYKJAK3JAK2CDK9
SCHEMBL4286534 0.91 JAK2 (0.39) BRD4SYKSLC2A1JAK3JAK2
SCHEMBL4279808 0.91 JAK2 (0.39) BRD4SYKSLC2A1JAK3JAK2
SCHEMBL4284707 0.86 JAK3 (0.38) BRD4SYKJAK3JAK2CDK9
SCHEMBL4282420 0.86 JAK3 (0.38) BRD4SYKJAK3JAK2CDK9
SCHEMBL4284581 0.83 PAK1 (0.39) BRD4SYKJAK3JAK2CDK9
SCHEMBL4291726 0.83 PAK1 (0.39) BRD4SYKJAK3JAK2CDK9
SCHEMBL4284314 0.83 PAK1 (0.39) BRD4SYKJAK3JAK2CDK9

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 BRD4 2051/4885SYK 4857/4885SLC2A1 2698/4885
US-20140213585-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES JAK2, JAK1, JAK3 BRD4 251/4885SYK 36/4885SLC2A1 4179/4885
US-20130018041-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES JAK2, JAK1, JAK3 BRD4 468/4885SYK 39/4885SLC2A1 4544/4885
US-20090258864-A1 PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES JAK2, JAK1, JAK3 BRD4 535/4885SYK 46/4885SLC2A1 4582/4885

“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.