SCHEMBL9911243

SCHEMBL9911243

COc1ccc(OC)c(Nc2ncc(Br)c(Nc3ccc(C)cc3NS(C)(=O)=O)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 2/20 0.55
EGFR P00533 9/20 0.54
PTK2 Q05397 1/20 0.53
IGF1R P08069 2/20 0.52
ULK1 O75385 2/20 0.48
MAPK3 P27361 2/20 0.45
ALK Q9UM73 1/20 0.43

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
SCHEMBL1707782 0.95 ZAP70 (0.59) ZAP70EGFRPTK2IGF1RULK1
SCHEMBL1707698 0.90 PTK2 (0.64) ZAP70EGFRPTK2IGF1RULK1
SCHEMBL9911242 0.89 EGFR (0.55) EGFRPTK2MAPK3ALK
SCHEMBL9911245 0.89 GSK3A (0.53) EGFRPTK2MAPK3ALK
SCHEMBL1707236 0.89 EGFR (0.55) EGFRPTK2MAPK3ALK
SCHEMBL1707723 0.88 ZAP70 (0.53) ZAP70EGFRPTK2IGF1RULK1
SCHEMBL12726558 0.86 EGFR (0.53) ZAP70EGFRPTK2IGF1RULK1
SCHEMBL1038417 0.86 ZAP70 (0.54) ZAP70EGFRPTK2IGF1RULK1
SCHEMBL12726557 0.84 ULK1 (0.61) ZAP70EGFRPTK2IGF1RULK1
SCHEMBL1038018 0.84 ULK1 (0.61) ZAP70EGFRPTK2IGF1RULK1

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 1 patent. 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

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 1/4885EGFR 3420/4885PTK2 1584/4885

“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.