SCHEMBL9911242

SCHEMBL9911242

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

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.55
LRRK2 Q5S007 2/20 0.54
MET P08581 1/20 0.54
ALK Q9UM73 3/20 0.54
ROS1 P08922 1/20 0.54
PTK2 Q05397 1/20 0.53
MAPK3 P27361 1/20 0.52
INSR P06213 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
SCHEMBL1707236 1.00 EGFR (0.55) EGFRLRRK2METALKROS1
SCHEMBL1708506 0.95 EGFR (0.59) EGFRLRRK2METALKROS1
SCHEMBL9912362 0.94 EGFR (0.60) EGFRLRRK2METALKROS1
SCHEMBL9911248 0.94 ALK (0.61) EGFRLRRK2METALKROS1
Hydrochloric Acid SCHEMBL1707157 0.93 EGFR (0.59) EGFRLRRK2METALKROS1
SCHEMBL9911249 0.91 ROS1 (0.53) EGFRLRRK2METALKROS1
SCHEMBL9912344 0.91 ROS1 (0.53) EGFRLRRK2METALKROS1
SCHEMBL1707362 0.90 EGFR (0.50) EGFRLRRK2METALKROS1
SCHEMBL1707303 0.90 MAPK3 (0.56) EGFRLRRK2METALKROS1
SCHEMBL9911250 0.90 MAPK3 (0.56) EGFRLRRK2METALKROS1

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 EGFR 3420/4885LRRK2 3072/4885MET 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.