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SCHEMBL17461349

SCHEMBL17461349

COC1OC(CO)C(OC2OC(CO)C(OC)C(OC3OC(CO)C(OC4CC(CO)C(O)C(OC5(OC=O)CC(O)C(C)C(C(O)[C@@H](O)CO)O5)C4O)C(O)C3NC(C)=O)C2O)C(O)C1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SIGLEC7 Q9Y286 6/20 0.43
▸ MAG P20916 6/20 0.42
▸ SELE P16581 5/20 0.40
▸ SELL P14151 1/20 0.39
▸ SELP P16109 1/20 0.39
▸ LGALS1 P09382 1/20 0.36
▸ LGALS3 P17931 1/20 0.36
▸ LGALS7; LGALS7B P47929 1/20 0.36

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
SCHEMBL17461352 0.97 MAG (0.45) SIGLEC7MAGSELESELLSELP
SCHEMBL17754966 0.93 MAG (0.48) SIGLEC7MAGSELESELLSELP
SCHEMBL17754965 0.91 MAG (0.49) SIGLEC7MAGSELESELLSELP
SCHEMBL17946217 0.88 MAG (0.49) SIGLEC7MAGSELESELLSELP
SCHEMBL25446563 0.84 MAG (0.50) SIGLEC7MAGSELESELLSELP
SCHEMBL16342337 0.84 MAG (0.50) SIGLEC7MAGSELESELLSELP
SCHEMBL16187872 0.84 MAG (0.50) SIGLEC7MAGSELESELLSELP
SCHEMBL12196998 0.84 MAG (0.50) SIGLEC7MAGSELESELLSELP
SCHEMBL16187918 0.84 MAG (0.50) SIGLEC7MAGSELESELLSELP
SCHEMBL13059905 0.83 SIGLEC7 (0.41) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9243271-B2 Fermentation processes for cultivating Streptococci and purification processes for obtaining cps therefrom NOVARTIS AG (CH) 2016-01-26 — — US disclosed
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