SCHEMBL9911239

SCHEMBL9911239

CCc1ccccc1Nc1ncc(Br)c(Nc2ccccc2NS(C)(=O)=O)n1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.58
PTGS1 P23219 1/20 0.54
IGF1R P08069 1/20 0.52
GLO1 Q04760 2/20 0.51
ALK Q9UM73 2/20 0.48
CDK1 P06493 1/20 0.47
CDK2 P24941 1/20 0.47
KDR P35968 1/20 0.47
ZAP70 P43403 4/20 0.47
PTK2 Q05397 2/20 0.47
MAPK8 P45983 1/20 0.46
MET P08581 1/20 0.46

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 SCHEMBL1707410 0.99 EGFR (0.57) EGFRPTGS1IGF1RGLO1ALK
SCHEMBL9911244 0.86 EGFR (0.57) EGFRPTGS1IGF1RGLO1ALK
SCHEMBL9911240 0.85 EGFR (0.56) EGFRIGF1RGLO1ALKCDK1
SCHEMBL9911238 0.85 IGF1R (0.74) EGFRPTGS1IGF1RGLO1ALK
SCHEMBL9911237 0.85 GLO1 (0.60) EGFRIGF1RGLO1ALKCDK1
Hydrochloric Acid SCHEMBL1706872 0.85 EGFR (0.56) EGFRPTGS1IGF1RGLO1ALK
SCHEMBL12726459 0.85 CDK1 (0.65) EGFRPTGS1IGF1RGLO1ALK
Hydrochloric Acid SCHEMBL1707517 0.84 EGFR (0.55) EGFRIGF1RGLO1ALKCDK1
Hydrochloric Acid SCHEMBL1706957 0.84 GLO1 (0.59) EGFRIGF1RGLO1ALKCDK1
Hydrochloric Acid SCHEMBL1707837 0.84 IGF1R (0.73) EGFRPTGS1IGF1RGLO1ALK

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 3420/4885PTGS1 2503/4885IGF1R 3176/4885

“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.