SCHEMBL21078705

SCHEMBL21078705

CCCCC1OC(CO)C(O)C(O)C1C

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.46
PYGB P11216 3/20 0.41
GAA P10253 1/20 0.40
OGA O60502 2/20 0.39
GBA1 P04062 1/20 0.38
LGALS1 P09382 2/20 0.37
LGALS3 P17931 2/20 0.37
LGALS9 O00182 1/20 0.37
LGALS8 O00214 1/20 0.37
MAPK1 P28482 1/20 0.37
HEXA P06865 1/20 0.36
HEXB P07686 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
SCHEMBL23848867 0.89 PYGB (0.44) GLAPYGBGAAOGALGALS1
SCHEMBL9621629 0.88 OGA (0.42) PYGBGAAOGAGBA1LGALS1
SCHEMBL12993503 0.86 GBA1 (0.46) PYGBGAAOGAGBA1LGALS1
SCHEMBL16644800 0.86 GBA1 (0.46) PYGBGAAOGAGBA1LGALS1
SCHEMBL16628196 0.86 GBA1 (0.46) PYGBGAAOGAGBA1LGALS1
SCHEMBL23848882 0.86 GBA1 (0.46) PYGBGAAOGAGBA1LGALS1
SCHEMBL8347365 0.86 GBA1 (0.46) PYGBGAAOGAGBA1LGALS1
SCHEMBL14028866 0.86 GBA1 (0.46) PYGBGAAOGAGBA1LGALS1
SCHEMBL18051737 0.81 GBA1 (0.46) PYGBGAAGBA1LGALS1LGALS3
SCHEMBL13957969 0.80 LGALS1 (0.42) PYGBGAAOGALGALS1LGALS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021188586-A1 METHOD OF TREATING VIRAL INFECTIONS WITH HEXOSE TYPE MONOSACCHARIDES AND ANALOGS THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-09-23 WO disclosed
EP-3492477-A1 BORON-CONTAINING COMPOUND Stella Pharma Corporation (JP) 2019-06-05 EP disclosed