SCHEMBL1707654

SCHEMBL1707654

COc1ccc(Nc2ncc(Br)c(Nc3ccccc3NS(C)(=O)=O)n2)c(OC)c1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 2/20 0.73
PTK2 Q05397 1/20 0.73
EGFR P00533 15/20 0.71
ROS1 P08922 1/20 0.58
ALK Q9UM73 1/20 0.58
LRRK2 Q5S007 2/20 0.56
MET P08581 1/20 0.56
GSK3A P49840 1/20 0.56
MAPK15 Q8TD08 1/20 0.56
CAMKK2 Q96RR4 1/20 0.56

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
SCHEMBL1707698 0.92 PTK2 (0.64) ZAP70PTK2EGFRROS1ALK
SCHEMBL9911241 0.90 EGFR (0.69) ZAP70PTK2EGFRALKLRRK2
SCHEMBL1707870 0.89 EGFR (0.69) ZAP70PTK2EGFRLRRK2MET
Hydrochloric Acid SCHEMBL1708532 0.89 EGFR (0.68) ZAP70PTK2EGFRALKLRRK2
SCHEMBL1707703 0.88 PTK2 (0.73) ZAP70PTK2EGFRROS1ALK
SCHEMBL1707782 0.88 ZAP70 (0.59) ZAP70PTK2EGFRROS1ALK
SCHEMBL1036482 0.86 GLO1 (0.64) ZAP70PTK2EGFRALK
SCHEMBL12856125 0.85 ZAP70 (0.81) ZAP70PTK2EGFRALKMET
SCHEMBL1039787 0.85 EGFR (0.59) ZAP70PTK2EGFRALK
SCHEMBL375886 0.85 ZAP70 (1.00) ZAP70PTK2EGFRROS1ALK

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 9 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 claimed
EP-2440534-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS Cellzome Limited (GB) 2012-04-18 EP claimed
WO-2010142766-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2010-12-16 WO claimed
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 US disclosed
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 US disclosed
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
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.