SCHEMBL167899

SCHEMBL167899

O=C(Nc1cccc(F)c1)c1cc(C(F)(F)F)c(CN2CCOCC2)cc1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.54
LRRK2 Q5S007 6/20 0.54
RXFP1 Q9HBX9 1/20 0.47
NPC1 O15118 2/20 0.47
TP53 P04637 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KCNH2 Q12809 2/20 0.46
CYP3A4 P08684 1/20 0.45
SLCO1B1 Q9Y6L6 1/20 0.45
ABL1 P00519 1/20 0.45
PTGER1 P34995 2/20 0.45
MAPT P10636 2/20 0.44
KIT P10721 1/20 0.43

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
SCHEMBL165468 0.91 LRRK2 (0.59) METLRRK2RXFP1NPC1TP53
SCHEMBL167994 0.87 LRRK2 (0.60) METLRRK2CYP3A4SLCO1B1
SCHEMBL257184 0.85 LRRK2 (0.64) LRRK2KCNH2CYP3A4SLCO1B1
SCHEMBL167180 0.84 PTGER1 (0.45) TP53SMN1; SMN2ALDH1A1PTGER1MAPT
SCHEMBL168763 0.83 HCRTR1 (0.46) SMN1; SMN2ALDH1A1KCNH2ABL1PTGER1
SCHEMBL256458 0.79 LRRK2 (0.62) METLRRK2
SCHEMBL168123 0.78 LRRK2 (0.60) METLRRK2NPC1RAB9ASMN1; SMN2
SCHEMBL257191 0.77 LRRK2 (0.63) LRRK2KCNH2CYP3A4SLCO1B1
SCHEMBL166061 0.75 HRH3 (0.51) NPC1RAB9ASMN1; SMN2ALDH1A1PTGER1
SCHEMBL21644610 0.75 KDM1A (0.50) METLRRK2NPC1TP53RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611772-B1 2-(BENZYLOXY)BENZAMIDES AS LRRK2 KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2014-09-24 EP claimed
US-9365551-B2 2-(benzyloxy) benzamides as LRRK2 kinase inhibitors GLAXO GROUP LIMITED (GB) 2016-06-14 US disclosed
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
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
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
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 MET 3646/4885LRRK2 1/4885RXFP1 4693/4885

“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.