SCHEMBL15059211

SCHEMBL15059211

Cc1cnc(Nc2cnn(CC(F)F)c2)nc1NC[C@H]1CCN(CCS(C)(=O)=O)C1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 12/20 0.43
JAK2 O60674 6/20 0.43
JAK1 P23458 6/20 0.42
BTK Q06187 4/20 0.41
PRKCQ Q04759 3/20 0.40
AURKA O14965 4/20 0.40
AURKB Q96GD4 4/20 0.40

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
SCHEMBL15059213 1.00 JAK3 (0.43) JAK3JAK2JAK1BTKPRKCQ
SCHEMBL15059532 0.87 JAK2 (0.45) JAK3JAK2JAK1PRKCQAURKB
SCHEMBL15059530 0.87 JAK2 (0.45) JAK3JAK2JAK1PRKCQAURKB
SCHEMBL15059333 0.84 JAK3 (0.42) JAK3JAK2JAK1BTKPRKCQ
SCHEMBL15059710 0.84 JAK3 (0.42) JAK3JAK2JAK1BTKPRKCQ
SCHEMBL15059714 0.83 JAK1 (0.43) JAK3JAK2JAK1BTKAURKA
SCHEMBL16338128 0.80 JAK1 (0.53) JAK3JAK2JAK1AURKAAURKB
SCHEMBL15056132 0.80 JAK1 (0.53) JAK3JAK2JAK1AURKAAURKB
SCHEMBL15058430 0.79 JAK1 (0.53) JAK3JAK2JAK1BTKAURKA
SCHEMBL15058429 0.79 JAK1 (0.53) JAK3JAK2JAK1BTKAURKA

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-20150005281-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2015-01-01 US claimed
US-20150005281-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2015-01-01 US disclosed
US-20150005277-A1 Protein Kinase Inhibitors and Uses Thereof BEIGENE, LTD. (KY) 2015-01-01 US disclosed
US-20150005281-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2015-01-01 US disclosed
US-20150005281-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2015-01-01 US disclosed
EP-2794598-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS Cellzome Limited (GB) 2014-10-29 EP disclosed
WO-2013092854-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2013-06-27 WO disclosed
WO-2013092854-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2013-06-27 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-20150005277-A1 Protein Kinase Inhibitors and Uses Thereof BTK, ABL1, PRKACA JAK3 64/4885JAK2 14/4885JAK1 16/4885
US-20150005281-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS JAK2, JAK1, JAK3 JAK3 3/4885JAK2 1/4885JAK1 2/4885

“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.