SCHEMBL1707787

SCHEMBL1707787

COc1ccc(Nc2nc(Nc3ccccc3F)ncc2Cl)c(NS(C)(=O)=O)c1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.58
MET P08581 1/20 0.57
LRRK2 Q5S007 1/20 0.57
ROS1 P08922 4/20 0.57
ALK Q9UM73 4/20 0.57
MAPK3 P27361 1/20 0.55
PTK2 Q05397 1/20 0.54
GLO1 Q04760 2/20 0.53

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
SCHEMBL1707678 0.93 EGFR (0.54) EGFRMETLRRK2ROS1ALK
SCHEMBL9912338 0.93 EGFR (0.54) EGFRMETLRRK2ROS1ALK
Hydrochloric Acid SCHEMBL1707940 0.92 EGFR (0.53) EGFRMETLRRK2ROS1ALK
SCHEMBL9912359 0.92 EGFR (0.53) EGFRMETLRRK2ROS1ALK
Hydrochloric Acid SCHEMBL1708480 0.91 EGFR (0.53) EGFRMETLRRK2ROS1ALK
SCHEMBL9912363 0.90 EGFR (0.66) EGFRMETLRRK2ROS1ALK
SCHEMBL9912357 0.90 ROS1 (0.59) EGFRMETLRRK2ROS1ALK
SCHEMBL1707362 0.89 EGFR (0.50) EGFRMETLRRK2ROS1ALK
SCHEMBL1706960 0.89 EGFR (0.50) EGFRMETLRRK2ROS1ALK
Hydrochloric Acid SCHEMBL1706865 0.89 ROS1 (0.59) EGFRMETLRRK2ROS1ALK

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 8 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
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 EGFR 3420/4885MET 4788/4885LRRK2 3072/4885

“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.