SCHEMBL22199891

SCHEMBL22199891

CCCOC1CC(O)C(O)C(CO)O1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGALS8 O00214 1/20 0.45
LGALS3 P17931 1/20 0.45
LGALS4 P56470 1/20 0.45
MAPK1 P28482 1/20 0.35
SLC5A1 P13866 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
PTPN1 P18031 1/20 0.33
ATP1A1 P05023 1/20 0.33
ATP1B1 P05026 1/20 0.33
ATP1A3 P13637 1/20 0.33
ATP1B2 P14415 1/20 0.33
ATP1A2 P50993 1/20 0.33
ATP1B3 P54709 1/20 0.33
FXYD2 P54710 1/20 0.33
ATP1A4 Q13733 1/20 0.33
PYGB P11216 3/20 0.33
SELP P16109 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL19774686 1.00 LGALS8 (0.45) LGALS8LGALS3LGALS4MAPK1SLC5A1
SCHEMBL23025973 1.00 LGALS8 (0.45) LGALS8LGALS3LGALS4MAPK1SLC5A1
SCHEMBL20306671 0.90 LGALS8 (0.49) LGALS8LGALS3LGALS4MAPK1
SCHEMBL16148734 0.89 LGALS8 (0.51) LGALS8LGALS3LGALS4MAPK1
SCHEMBL16148735 0.89 LGALS8 (0.51) LGALS8LGALS3LGALS4MAPK1
SCHEMBL19297763 0.88 LGALS8 (0.35) LGALS8LGALS3LGALS4
SCHEMBL19772749 0.88 LGALS8 (0.53) LGALS8LGALS3LGALS4MAPK1
SCHEMBL24155775 0.88 LGALS8 (0.53) LGALS8LGALS3LGALS4MAPK1
SCHEMBL469613 0.88 LGALS8 (0.53) LGALS8LGALS3LGALS4MAPK1
SCHEMBL24473712 0.86 LGALS3 (0.41) LGALS8LGALS3LGALS4MAPK1SLC5A1

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
EP-3677679-A1 SIRNA MOLECULE INHIBITING PCSK9 GENE EXPRESSION AND APPLICATION THEREOF Guangzhou Ribobio Co., Ltd. (CN) 2020-07-08 EP disclosed