SCHEMBL167487

SCHEMBL167487

COC(=O)c1cc(C(F)(F)F)c(CBr)cc1OC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CFTR P13569 6/20 0.40
NOTUM Q6P988 2/20 0.39
SOS1 Q07889 1/20 0.36
POLB P06746 1/20 0.35
CFD P00746 2/20 0.34
LMNA P02545 1/20 0.34
EPHX2 P34913 1/20 0.33
BACE1 P56817 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33

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
SCHEMBL166131 0.81 KDM4E (0.39) KDM4EALDH1A1HPGDHSD17B10SOS1
SCHEMBL167207 0.81 POLB (0.48) KDM4EALDH1A1USP2HPGDCYP2C19
SCHEMBL20539831 0.80 HTT (0.46) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL166010 0.79 KDM4E (0.41) KDM4EALDH1A1USP2HPGDCYP2C19
SCHEMBL28617100 0.79 TNFSF11 (0.41) KDM4EALDH1A1USP2HPGDHSD17B10
SCHEMBL167752 0.78 KDM4E (0.39) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL6639317 0.74 CFTR (0.44) KDM4EALDH1A1HPGDCYP2C19CFTR
SCHEMBL17185131 0.74 CYP4F2 (0.39) KDM4EALDH1A1HPGDHSD17B10SOS1
SCHEMBL8521897 0.73 HMGCR (0.43) KDM4ECFTRNOTUMEPHX2
SCHEMBL23727980 0.72 NOTUM (0.52) ALDH1A1CFTRNOTUMSOS1LMNA

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 KDM4E 1447/4885ALDH1A1 3544/4885USP2 1681/4885

“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.