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SCHEMBL17754966

SCHEMBL17754966

COC1OC(CO)C(OC2OC(CO)C(OC)C(OC3OC(CO)C(OC4OC(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 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAG P20916 6/20 0.48
▸ SIGLEC7 Q9Y286 6/20 0.46
▸ SELE P16581 5/20 0.44
▸ SELL P14151 1/20 0.42
▸ SELP P16109 1/20 0.42
▸ LGALS1 P09382 1/20 0.41
▸ LGALS3 P17931 1/20 0.41
▸ LGALS7; LGALS7B P47929 1/20 0.41

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
SCHEMBL17754965 0.98 MAG (0.49) MAGSIGLEC7SELESELLSELP
SCHEMBL17946217 0.95 MAG (0.49) MAGSIGLEC7SELESELLSELP
SCHEMBL17461349 0.93 SIGLEC7 (0.43) MAGSIGLEC7SELESELLSELP
SCHEMBL17461352 0.92 MAG (0.45) MAGSIGLEC7SELESELLSELP
SCHEMBL25446563 0.91 MAG (0.50) MAGSIGLEC7SELESELLSELP
SCHEMBL16342337 0.91 MAG (0.50) MAGSIGLEC7SELESELLSELP
SCHEMBL16187872 0.91 MAG (0.50) MAGSIGLEC7SELESELLSELP
SCHEMBL12196998 0.91 MAG (0.50) MAGSIGLEC7SELESELLSELP
SCHEMBL16187918 0.91 MAG (0.50) MAGSIGLEC7SELESELLSELP
SCHEMBL13059905 0.91 SIGLEC7 (0.41) MAGSIGLEC7SELESELLSELP

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-20160137973-A1 FERMENTATION PROCESSES FOR CULTIVATING STREPTOCOCCI AND PURIFICATION PROCESSES FOR OBTAINING CPS THEREFROM NOVARTIS VACCINES AND DIAGNOSTICS SRL (IT) 2016-05-19 — — US disclosed
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