SCHEMBL9911267

SCHEMBL9911267

COc1ccc(Nc2nc(Nc3cc(OCCN)ccc3OC)ncc2Cl)c(NS(C)(=O)=O)c1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.59
ALK Q9UM73 8/20 0.55
ROS1 P08922 2/20 0.55
INSR P06213 4/20 0.51
MET P08581 1/20 0.51
LRRK2 Q5S007 1/20 0.51
PTK2 Q05397 1/20 0.50

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 SCHEMBL1707409 0.99 EGFR (0.59) EGFRALKROS1INSRMET
SCHEMBL1706889 0.95 ALK (0.61) EGFRALKROS1METLRRK2
SCHEMBL1708506 0.92 EGFR (0.59) EGFRALKROS1INSRMET
SCHEMBL1707403 0.91 ALK (0.51) EGFRALKROS1INSRMET
SCHEMBL1707659 0.91 EGFR (0.59) EGFRALKROS1METLRRK2
SCHEMBL1707353 0.91 ALK (0.51) EGFRALKROS1INSRMET
SCHEMBL1707848 0.88 EGFR (0.54) EGFRALKROS1INSRMET
SCHEMBL1707373 0.88 EGFR (0.54) EGFRALKROS1METLRRK2
SCHEMBL9911242 0.88 EGFR (0.55) EGFRALKROS1INSRMET
SCHEMBL1707236 0.88 EGFR (0.55) EGFRALKROS1INSRMET

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 3420/4885ALK 2709/4885ROS1 1188/4885

“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.