SCHEMBL14697149

SCHEMBL14697149

O=C(O)N[C@@H]1[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H](COCc2ccccc2)C[C@@H]1O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.41
ACHE P22303 2/20 0.41
EPHX2 P34913 2/20 0.39
PDE4D Q08499 1/20 0.39
PDPK1 O15530 1/20 0.38
MTOR P42345 1/20 0.38
AGTR2 P50052 2/20 0.38
SSTR4 P31391 1/20 0.37
TACR2 P21452 3/20 0.37
ATM Q13315 1/20 0.37
AXL P30530 1/20 0.36
MERTK Q12866 1/20 0.36
NT5E P21589 1/20 0.36
GJB2 P29033 1/20 0.36

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
SCHEMBL14583809 0.82 BCHE (0.49) BCHEACHEPDE4DPDPK1MTOR
SCHEMBL21783270 0.82 BCHE (0.49) BCHEACHEPDE4DPDPK1MTOR
SCHEMBL13424410 0.82 BCHE (0.49) BCHEACHEPDE4DPDPK1MTOR
SCHEMBL13562761 0.82 BCHE (0.49) BCHEACHEPDE4DPDPK1MTOR
SCHEMBL2582793 0.82 BCHE (0.49) BCHEACHEPDE4DPDPK1MTOR
SCHEMBL2580825 0.82 BCHE (0.49) BCHEACHEPDE4DPDPK1MTOR
SCHEMBL12152898 0.82 BCHE (0.49) BCHEACHEPDE4DPDPK1MTOR
SCHEMBL15877138 0.81 ALDH1A1 (0.38) BCHEACHEPDE4DAXLMERTK
SCHEMBL14957991 0.81 NPC1 (0.39) BCHEACHEPDE4D
SCHEMBL21783307 0.80 BCHE (0.46) BCHEACHEEPHX2PDE4DPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2744338-B1 SELECTIVE GLYCOSIDASE INHIBITORS AND USES THEREOF MERCK SHARP & DOHME (US) 2016-04-27 EP disclosed
EP-2569291-B1 SELECTIVE GLYCOSIDASE INHIBITORS AND USES THEREOF UNIV FRASER SIMON (CA) 2016-04-06 EP disclosed
US-9120781-B2 Selective glycosidase inhibitors and uses thereof SIMON FRASER UNIVERSITY (CA) 2015-09-01 US disclosed
EP-2744338-A1 SELECTIVE GLYCOSIDASE INHIBITORS AND USES THEREOF Merck Sharp & Dohme Corp. (US) 2014-06-25 EP disclosed
US-20130131044-A1 SELECTIVE GLYCOSIDASE INHIBITORS AND USES THEREOF SIMON FRASER UNIVERSITY (CA) 2013-05-23 US disclosed
WO-2013025452-A1 SELECTIVE GLYCOSIDASE INHIBITORS AND USES THEREOF MERCK SHARP & DOHME CORP. (US) 2013-02-21 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-20130131044-A1 SELECTIVE GLYCOSIDASE INHIBITORS AND USES THEREOF ENGASE, OGA, GALE BCHE 632/4885ACHE 1227/4885EPHX2 808/4885

“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.