SCHEMBL9911236

SCHEMBL9911236

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

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 15/20 0.64
PTK2 Q05397 1/20 0.64
MET P08581 1/20 0.63
LRRK2 Q5S007 1/20 0.63
ALK Q9UM73 3/20 0.62
ROS1 P08922 2/20 0.62
MAPK3 P27361 1/20 0.59
INSR P06213 1/20 0.58

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 SCHEMBL1707842 0.99 EGFR (0.63) EGFRPTK2METLRRK2ALK
SCHEMBL1708506 0.94 EGFR (0.59) EGFRPTK2METLRRK2ALK
SCHEMBL9912363 0.93 EGFR (0.66) EGFRPTK2METLRRK2ALK
Hydrochloric Acid SCHEMBL1707538 0.92 EGFR (0.65) EGFRPTK2METLRRK2ALK
SCHEMBL1707766 0.90 EGFR (0.61) EGFRMETLRRK2ALKROS1
SCHEMBL9911242 0.90 EGFR (0.55) EGFRPTK2METLRRK2ALK
SCHEMBL1707236 0.90 EGFR (0.55) EGFRPTK2METLRRK2ALK
SCHEMBL1707303 0.89 MAPK3 (0.56) EGFRPTK2METLRRK2ALK
SCHEMBL1707028 0.88 EGFR (0.59) EGFRPTK2METLRRK2ALK
SCHEMBL1708502 0.88 GLO1 (0.65) EGFRPTK2METLRRK2ALK

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 3420/4885PTK2 1584/4885MET 4788/4885

“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.