SCHEMBL1707277

SCHEMBL1707277

COc1ccc(Nc2nc(Cl)ncc2Br)c(NS(C)(=O)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 2/20 0.46
PTK2 Q05397 2/20 0.46
EGFR P00533 3/20 0.46
PIK3CG P48736 4/20 0.44
ULK1 O75385 1/20 0.41
IGF1R P08069 1/20 0.41
PTGS1 P23219 2/20 0.40
PTGS2 P35354 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ROS1 P08922 1/20 0.39
ALK Q9UM73 1/20 0.39
PIK3CA P42336 1/20 0.39
MTOR P42345 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
SCHEMBL602789 0.89 EGFR (0.48) PTK2EGFRPIK3CGROS1ALK
SCHEMBL31664180 0.89 EGFR (0.48) PTK2EGFRPIK3CGROS1ALK
SCHEMBL601464 0.87 GLO1 (0.50) PTK2EGFRPIK3CGPTGS1PTGS2
SCHEMBL1708523 0.84 PTK2 (0.50) ZAP70PTK2EGFRULK1ROS1
SCHEMBL25056292 0.84 ZAP70 (0.45) ZAP70EGFRPIK3CGIGF1RPTGS1
SCHEMBL29904729 0.84 ZAP70 (0.45) ZAP70EGFRPIK3CGIGF1RPTGS1
SCHEMBL26906847 0.84 EGFR (0.48) PTK2EGFRPIK3CGPTGS1PTGS2
SCHEMBL30659886 0.84 EGFR (0.48) PTK2EGFRPIK3CGPTGS1PTGS2
SCHEMBL1707782 0.83 ZAP70 (0.59) ZAP70PTK2EGFRULK1IGF1R
SCHEMBL600898 0.82 GLO1 (0.51) PTK2EGFRIGF1RPTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 US disclosed
EP-2440534-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS Cellzome Limited (GB) 2012-04-18 EP disclosed
WO-2010142766-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2010-12-16 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-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS ZAP70, LCK, DPY30 ZAP70 1/4885PTK2 1584/4885EGFR 3420/4885

“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.