SCHEMBL17178259

SCHEMBL17178259

O[C@@H]1[C@@H](O)[C@H](O)O[C@@H](O)[C@H]1O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 3/20 0.47
LMNA P02545 1/20 0.46
APP P05067 1/20 0.46
LGALS1 P09382 2/20 0.33
LGALS3 P17931 2/20 0.33
LGALS9 O00182 1/20 0.33
LGALS8 O00214 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
SCHEMBL16812686 1.00 GBA1 (0.47) GBA1LMNAAPPLGALS1LGALS3
SCHEMBL16550452 1.00 GBA1 (0.47) GBA1LMNAAPPLGALS1LGALS3
SCHEMBL11915509 1.00 GBA1 (0.47) GBA1LMNAAPPLGALS1LGALS3
SCHEMBL14191363 1.00 GBA1 (0.47) GBA1LMNAAPPLGALS1LGALS3
SCHEMBL10076292 1.00 GBA1 (0.47) GBA1LMNAAPPLGALS1LGALS3
SCHEMBL12017371 1.00 GBA1 (0.47) GBA1LMNAAPPLGALS1LGALS3
SCHEMBL9613597 1.00 GBA1 (0.47) GBA1LMNAAPPLGALS1LGALS3
SCHEMBL14191362 1.00 GBA1 (0.47) GBA1LMNAAPPLGALS1LGALS3
SCHEMBL22043674 1.00 GBA1 (0.47) GBA1LMNAAPPLGALS1LGALS3
SCHEMBL13444711 0.95

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150290333-A1 PROCESS AND MATERIALS FOR MEDICAL APPLICATIONS NATIONAL UNIVERSITY OF SINGAPORE (SG) 2015-10-15 US disclosed