SCHEMBL9911241

SCHEMBL9911241

COc1ccccc1Nc1ncc(Br)c(Nc2ccccc2NS(C)(=O)=O)n1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.69
CDK19 Q9BWU1 1/20 0.60
ALK Q9UM73 1/20 0.60
ZAP70 P43403 2/20 0.58
PTK2 Q05397 1/20 0.56
PTGS1 P23219 1/20 0.55
LRRK2 Q5S007 2/20 0.54
MET P08581 1/20 0.54
IGF1R P08069 1/20 0.54
ULK1 O75385 1/20 0.54
GSK3A P49840 1/20 0.54
MAPK15 Q8TD08 1/20 0.54
CAMKK2 Q96RR4 1/20 0.54

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
Hydrochloric Acid SCHEMBL1708532 0.99 EGFR (0.68) EGFRCDK19ALKZAP70PTK2
SCHEMBL1707650 0.92 EGFR (0.63) EGFRCDK19ALKZAP70PTK2
SCHEMBL1707870 0.90 EGFR (0.69) EGFRZAP70PTK2LRRK2MET
SCHEMBL1707654 0.90 ZAP70 (0.73) EGFRALKZAP70PTK2LRRK2
SCHEMBL1707698 0.90 PTK2 (0.64) EGFRALKZAP70PTK2LRRK2
SCHEMBL1708495 0.87 EGFR (0.58) EGFRCDK19ALKZAP70LRRK2
SCHEMBL1706896 0.87 LRRK2 (0.68) EGFRPTK2PTGS1LRRK2MET
SCHEMBL1034549 0.86 ULK1 (0.73) EGFRCDK19ALKZAP70PTK2
SCHEMBL1037539 0.86 EGFR (0.62) EGFRCDK19ALKZAP70PTK2
SCHEMBL1039787 0.86 EGFR (0.59) EGFRCDK19ALKZAP70PTK2

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
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 US 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 EGFR 3420/4885CDK19 1507/4885ALK 2709/4885

“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.