SCHEMBL4787669

SCHEMBL4787669

COC1O[C@H](CO)[C@H](O)C1OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 10/20 0.48
LGALS4 P56470 4/20 0.48
FGF1 P05230 1/20 0.47
LGALS9 O00182 3/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
LGALS1 P09382 1/20 0.43
LGALS8 O00214 7/20 0.42
SLC5A2 P31639 1/20 0.40

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
SCHEMBL3316874 1.00 LGALS3 (0.48) LGALS3LGALS4FGF1LGALS9CA1
SCHEMBL3316862 1.00 LGALS3 (0.48) LGALS3LGALS4FGF1LGALS9CA1
SCHEMBL3316869 1.00 LGALS3 (0.48) LGALS3LGALS4FGF1LGALS9CA1
SCHEMBL9609370 0.86 LGALS3 (0.44) LGALS3LGALS4LGALS9CA1CA2
SCHEMBL28182370 0.84 SLC5A2 (0.48) LGALS9CA1CA2CA9SLC5A2
SCHEMBL7645735 0.83 SLC5A2 (0.50) LGALS9CA1CA2CA9SLC5A2
SCHEMBL8540246 0.83 SLC5A2 (0.50) LGALS9CA1CA2CA9SLC5A2
SCHEMBL5215790 0.83 SLC5A2 (0.50) LGALS9CA1CA2CA9SLC5A2
SCHEMBL14890371 0.83 SLC5A2 (0.50) LGALS9CA1CA2CA9SLC5A2
SCHEMBL29413019 0.83 SLC5A2 (0.50) LGALS9CA1CA2CA9SLC5A2

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
WO-2008100447-A2 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2008-08-21 WO disclosed