SCHEMBL10074552

SCHEMBL10074552

CS(=O)(=O)Nc1ccccc1Nc1nc(Nc2cccc(C#N)c2F)ncc1Cl

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 2/20 0.55
ALK Q9UM73 9/20 0.54
MET P08581 2/20 0.54
EGFR P00533 9/20 0.51
ROS1 P08922 6/20 0.51
LRRK2 Q5S007 1/20 0.50

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
SCHEMBL602870 0.90 GLO1 (0.62) GLO1ALKMETEGFRLRRK2
SCHEMBL13084445 0.85 ALK (0.58) GLO1ALKMETEGFRROS1
SCHEMBL600864 0.83 GLO1 (0.58) GLO1ALKMETEGFRROS1
SCHEMBL600894 0.83 GLO1 (0.56) GLO1ALKMETEGFRROS1
SCHEMBL603073 0.82 ALK (0.58) GLO1ALKMETEGFRROS1
SCHEMBL1039383 0.81 MAPK9 (0.66) GLO1ALKMETEGFRROS1
SCHEMBL602346 0.81 ULK1 (0.64) GLO1ALKMETROS1
SCHEMBL1036294 0.80 ALK (0.68) GLO1ALKMETEGFRLRRK2
SCHEMBL624680 0.80 ALK (0.55) GLO1ALKMETEGFRROS1
SCHEMBL1459616 0.80 EGFR (0.56) GLO1ALKMETEGFRROS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 3765/4885ALK 1095/4885MET 3143/4885

“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.