SCHEMBL600796

SCHEMBL600796

CS(=O)(=O)Nc1ccccc1Nc1nc(Nc2ccc(C#N)cc2F)ncc1F

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 4/20 0.61
GSK3A P49840 1/20 0.54
LRRK2 Q5S007 1/20 0.54
MAPK15 Q8TD08 1/20 0.54
CAMKK2 Q96RR4 1/20 0.54
SYK P43405 2/20 0.50
EGFR P00533 8/20 0.49
MET P08581 2/20 0.47
PTK2 Q05397 2/20 0.46
ZAP70 P43403 1/20 0.45
ALK Q9UM73 1/20 0.44

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
SCHEMBL604004 0.92 GLO1 (0.64) GLO1GSK3ALRRK2MAPK15CAMKK2
SCHEMBL600894 0.91 GLO1 (0.56) GLO1LRRK2EGFRMETALK
SCHEMBL1038933 0.88 GLO1 (0.76) GLO1GSK3ALRRK2MAPK15CAMKK2
SCHEMBL1460622 0.88 LRRK2 (0.59) GLO1GSK3ALRRK2MAPK15CAMKK2
SCHEMBL1038389 0.87 SYK (0.69) GLO1GSK3ALRRK2MAPK15CAMKK2
SCHEMBL1708529 0.86 GLO1 (0.67) GLO1GSK3ALRRK2MAPK15CAMKK2
SCHEMBL656107 0.86 GLO1 (0.78) GLO1GSK3ALRRK2MAPK15CAMKK2
SCHEMBL1707645 0.85 GLO1 (0.73) GLO1GSK3ALRRK2MAPK15CAMKK2
SCHEMBL10084069 0.85 GLO1 (0.64) GLO1GSK3ALRRK2MAPK15CAMKK2
Hydrochloric Acid SCHEMBL1707850 0.84 GLO1 (0.72) GLO1GSK3ALRRK2MAPK15CAMKK2

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
EP-2419423-A1 FLUORO SUBSTITUTED PYRIMIDINE COMPOUNDS AS JAK3 INHIBITORS Cellzome Limited (GB) 2012-02-22 EP claimed
US-20120040955-A1 FLUORO SUBSTITUTED PYRIMIDINE COMPOUNDS AS JAK3 INHIBITORS CELLZOME LIMITED (GB) 2012-02-16 US claimed
WO-2010118986-A1 FLUORO SUBSTITUTED PYRIMIDINE COMPOUNDS AS JAK3 INHIBITORS CELLZOME LIMITED (GB) 2010-10-21 WO claimed
EP-2419423-A1 FLUORO SUBSTITUTED PYRIMIDINE COMPOUNDS AS JAK3 INHIBITORS Cellzome Limited (GB) 2012-02-22 EP disclosed
US-20120040955-A1 FLUORO SUBSTITUTED PYRIMIDINE COMPOUNDS AS JAK3 INHIBITORS CELLZOME LIMITED (GB) 2012-02-16 US disclosed
US-20120040955-A1 FLUORO SUBSTITUTED PYRIMIDINE COMPOUNDS AS JAK3 INHIBITORS CELLZOME LIMITED (GB) 2012-02-16 US disclosed
WO-2010118986-A1 FLUORO SUBSTITUTED PYRIMIDINE COMPOUNDS AS JAK3 INHIBITORS CELLZOME LIMITED (GB) 2010-10-21 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 (1 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-20120040955-A1 FLUORO SUBSTITUTED PYRIMIDINE COMPOUNDS AS JAK3 INHIBITORS JAK3, JAK2, JAK1 GLO1 3765/4885GSK3A 744/4885LRRK2 1485/4885

“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.