SCHEMBL166755

SCHEMBL166755

COC(=O)c1cc(CN2CCOCC2)c(-c2cnn(C)c2)cc1OCc1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.47
HCRTR2 O43614 1/20 0.47
LRRK2 Q5S007 1/20 0.46
CCNC P24863 4/20 0.45
CDK8 P49336 4/20 0.45
GSK3B P49841 2/20 0.44
DYRK1A Q13627 2/20 0.44
CDK19 Q9BWU1 2/20 0.44
AXL P30530 1/20 0.43
MERTK Q12866 1/20 0.43
GRM2 Q14416 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CNR2 P34972 1/20 0.41
BDKRB1 P46663 1/20 0.41
ENPP2 Q13822 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
MET P08581 1/20 0.39
WNT1 P04628 1/20 0.38
SCN9A Q15858 1/20 0.38
PDE4B Q07343 1/20 0.38

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
SCHEMBL10192760 0.86 LRRK2 (0.54) LRRK2CCNCCDK8GSK3BDYRK1A
SCHEMBL176025 0.86 LRRK2 (0.67) LRRK2CCNCCDK8GSK3BDYRK1A
SCHEMBL167588 0.83 LRRK2 (0.67) LRRK2CCNCCDK8GSK3BDYRK1A
SCHEMBL165026 0.82 LRRK2 (0.46) LRRK2CCNCCDK8GSK3BDYRK1A
SCHEMBL166133 0.79 LRRK2 (0.44) LRRK2CCNCCDK8AXLMERTK
SCHEMBL10322212 0.78 LRRK2 (0.53) LRRK2GSK3BDYRK1AAXLMERTK
SCHEMBL165531 0.76 LRRK2 (0.46) LRRK2CCNCCDK8AXLMERTK
SCHEMBL168720 0.75 LRRK2 (0.66) LRRK2CCNCCDK8CDK19MET
SCHEMBL10192559 0.75 LRRK2 (0.60) LRRK2
SCHEMBL168574 0.74 MET (0.51) LRRK2CCNCCDK8GSK3BDYRK1A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365551-B2 2-(benzyloxy) benzamides as LRRK2 kinase inhibitors GLAXO GROUP LIMITED (GB) 2016-06-14 US disclosed
EP-2611772-B1 2-(BENZYLOXY)BENZAMIDES AS LRRK2 KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2014-09-24 EP disclosed
US-20130225584-A1 2-(BENZYLOXY) BENZAMIDES AS LRRK2 KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-08-29 US disclosed
EP-2611772-A1 2 - (BENZYLOXY) BENZAMIDES AS LRRK2 KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2013-07-10 EP disclosed
WO-2012028629-A1 2 - (BENZYLOXY) BENZAMIDES AS LRRK2 KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2012-03-08 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-20130225584-A1 2-(BENZYLOXY) BENZAMIDES AS LRRK2 KINASE INHIBITORS LRRK2, PARK7, BRSK2 HCRTR1 4213/4885HCRTR2 3121/4885LRRK2 1/4885

“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.