SCHEMBL17993082

SCHEMBL17993082

Cc1cc(-c2cn([C@@H]3C(O)[C@@H](Sc4cc(Cl)cc(Cl)c4)OC(CO)[C@@H]3O)nn2)cc(F)c1F

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 20/20 0.88

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
SCHEMBL19680670 0.94 LGALS3 (1.00) LGALS3
SCHEMBL19680676 0.94 LGALS3 (1.00) LGALS3
SCHEMBL17993157 0.94 LGALS3 (1.00) LGALS3
SCHEMBL17964137 0.94 LGALS3 (1.00) LGALS3
SCHEMBL17993210 0.92 LGALS3 (0.89) LGALS3
SCHEMBL19680995 0.87 LGALS3 (1.00) LGALS3
SCHEMBL17993162 0.87 LGALS3 (1.00) LGALS3
SCHEMBL19681066 0.87 LGALS3 (1.00) LGALS3
SCHEMBL19680647 0.87 LGALS3 (1.00) LGALS3
SCHEMBL17964121 0.87 LGALS3 (1.00) LGALS3

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-2016120403-A1 ALPHA-D-GALACTOSIDE INHIBITORS OF GALECTINS GALECTO BIOTECH AB (DK) 2016-08-04 — — WO disclosed
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