SCHEMBL8621909

SCHEMBL8621909

CO[C@]1(OC(C)=O)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PYGB P11216 9/20 0.46
PYGL P06737 3/20 0.38
PYGM P11217 2/20 0.38
SLC5A1 P13866 1/20 0.34
SLC5A2 P31639 1/20 0.34

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
SCHEMBL8619177 1.00 PYGB (0.46) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL28533632 0.84 PYGB (0.43) PYGBPYGLPYGM
SCHEMBL4950246 0.81 PYGB (0.41) PYGBPYGLPYGM
SCHEMBL4950538 0.81 PYGB (0.41) PYGBPYGLPYGM
SCHEMBL6931137 0.79 PYGB (0.43) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL7713761 0.79 PYGB (0.43) PYGBPYGLPYGMSLC5A1SLC5A2
SCHEMBL28858707 0.79 LGALS9 (0.43) PYGB
SCHEMBL4951061 0.79 PYGB (0.40) PYGBPYGLPYGM
SCHEMBL15125021 0.78 PYGB (0.48) PYGBPYGLPYGM
SCHEMBL28493519 0.78 PYGB (0.44) PYGBPYGLPYGM

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
EP-0816375-A1 GLYCOCONJUGATES OF OPIATED SUBSTANCES ROLABO SL (ES) 1998-01-07 EP claimed
EP-0816375-A1 GLYCOCONJUGATES OF OPIATED SUBSTANCES ROLABO SL (ES) 1998-01-07 EP disclosed