SCHEMBL1706896

SCHEMBL1706896

COc1ccccc1Nc1ncc(F)c(Nc2ccccc2NS(C)(=O)=O)n1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.68
GSK3A P49840 1/20 0.68
MAPK15 Q8TD08 1/20 0.68
CAMKK2 Q96RR4 1/20 0.68
GLO1 Q04760 3/20 0.67
AURKA O14965 1/20 0.63
EGFR P00533 11/20 0.59
MET P08581 1/20 0.57
PTK2 Q05397 2/20 0.56
PTGS1 P23219 1/20 0.55

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
SCHEMBL656107 0.91 GLO1 (0.78) LRRK2GSK3AMAPK15CAMKK2GLO1
SCHEMBL1707703 0.90 PTK2 (0.73) LRRK2GSK3AMAPK15CAMKK2GLO1
SCHEMBL1708502 0.90 GLO1 (0.65) LRRK2GSK3AMAPK15CAMKK2GLO1
SCHEMBL655352 0.88 AURKA (0.77) LRRK2GSK3AMAPK15CAMKK2AURKA
SCHEMBL1707645 0.87 GLO1 (0.73) LRRK2GSK3AMAPK15CAMKK2GLO1
SCHEMBL9911241 0.87 EGFR (0.69) LRRK2GSK3AMAPK15CAMKK2EGFR
SCHEMBL1034753 0.86 GLO1 (0.70) LRRK2GSK3AMAPK15CAMKK2GLO1
SCHEMBL1040110 0.86 PTK2 (0.71) LRRK2GSK3AMAPK15CAMKK2GLO1
SCHEMBL1460622 0.86 LRRK2 (0.59) LRRK2GSK3AMAPK15CAMKK2GLO1
SCHEMBL10012141 0.86 GLO1 (0.60) LRRK2GSK3AMAPK15CAMKK2GLO1

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 LRRK2 3072/4885GSK3A 1621/4885MAPK15 1620/4885

“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.