SCHEMBL16174061

SCHEMBL16174061

CCCCO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O)C(O[C@@H]3OC(CO[C@@H]4CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O4)[C@@H](O)C(O[C@@H]4OC(CO)[C@H](O)C(O[C@]5(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)C4O)C3NC(C)=O)C2O)C(O)C1O

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SIGLEC7 Q9Y286 6/20 0.69
▸ MAG P20916 8/20 0.55
▸ SELE P16581 4/20 0.53
▸ SELL P14151 1/20 0.52
▸ SELP P16109 1/20 0.52

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
SCHEMBL16174060 0.89 SIGLEC7 (0.73) SIGLEC7MAGSELESELLSELP
SCHEMBL18608215 0.87 SIGLEC7 (0.75) SIGLEC7MAGSELESELLSELP
SCHEMBL25068789 0.86 SIGLEC7 (0.68) SIGLEC7MAGSELESELLSELP
SCHEMBL29532983 0.85 SIGLEC7 (0.69) SIGLEC7MAGSELESELLSELP
SCHEMBL26172909 0.85 SIGLEC7 (0.66) SIGLEC7MAGSELESELLSELP
SCHEMBL19248964 0.85 SIGLEC7 (0.74) SIGLEC7MAGSELESELLSELP
SCHEMBL30650503 0.85 SIGLEC7 (0.74) SIGLEC7MAGSELESELLSELP
SCHEMBL31701080 0.85 SIGLEC7 (0.74) SIGLEC7MAGSELESELLSELP
SCHEMBL30970754 0.85 SIGLEC7 (0.72) SIGLEC7MAGSELESELLSELP
SCHEMBL18746386 0.85 SIGLEC7 (0.73) SIGLEC7MAGSELESELLSELP

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-2014167538-A1 SYNTHESIS OF SIALYLATED/FUCOSYLATED HUMAN MILK OLIGOSACCHARIDES GLYCOM A/S (DK) 2014-10-16 — — WO disclosed
WO-2014167537-A1 SYNTHESIS OF SIALYLATED/FUCOSYLATED OLIGOSACCHARIDES GLYCOM A/S (DK) 2014-10-16 — — WO disclosed
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