SCHEMBL1707697

SCHEMBL1707697

COc1ccc(Nc2nc(Nc3cc(OCCO)ccc3F)ncc2Cl)c(NS(C)(=O)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 5/20 0.51
ROS1 P08922 4/20 0.51
EGFR P00533 14/20 0.50
MAPK3 P27361 1/20 0.47
MET P08581 1/20 0.47
LRRK2 Q5S007 1/20 0.47

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
SCHEMBL1706863 0.95 ALK (0.51) ALKROS1EGFRMAPK3MET
SCHEMBL1707353 0.92 ALK (0.51) ALKROS1EGFRMAPK3MET
SCHEMBL1707984 0.92 ALK (0.53) ALKROS1EGFRMAPK3MET
SCHEMBL1707402 0.91 ALK (0.53) ALKROS1EGFRMAPK3MET
SCHEMBL1707368 0.91 ALK (0.53) ALKROS1EGFRMAPK3MET
SCHEMBL1707680 0.91 ALK (0.61) ALKROS1EGFRMAPK3MET
SCHEMBL1707659 0.91 EGFR (0.59) ALKROS1EGFRMAPK3MET
SCHEMBL1707362 0.88 EGFR (0.50) ALKROS1EGFRMAPK3MET
SCHEMBL1707403 0.87 ALK (0.51) ALKROS1EGFRMAPK3MET
SCHEMBL1707678 0.86 EGFR (0.54) ALKROS1EGFRMAPK3MET

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 9 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 claimed
EP-2440534-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS Cellzome Limited (GB) 2012-04-18 EP claimed
WO-2010142766-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2010-12-16 WO claimed
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
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 US disclosed
EP-2440534-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS Cellzome Limited (GB) 2012-04-18 EP disclosed
WO-2010142766-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2010-12-16 WO 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 ALK 2709/4885ROS1 1188/4885EGFR 3420/4885

“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.