SCHEMBL16350779

SCHEMBL16350779

CC(=O)N[C@H]1C([C@H](O)[C@H](O)CO)O[C@@](OCC2O[C@@H](O[C@H]3C(O)C(C)[C@H](OC4[C@@H](OCC5O[C@@H](O[C@@H]6C(CO)O[C@@H](O[C@@H]7C(CO)O[C@@H](NC(=O)CC(C)C(=O)O)[C@@H](C)C7O)[C@@H](C)C6O)[C@H](O)C(O[C@H]6O[C@H](CO)[C@@H](O)C(O)C6O[C@@H]6OC(CO)[C@@H](O[C@@H]7OC(CO[C@]8(C(=O)O)C[C@@H](O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O8)[C@H](O)[C@H](O)C7O)C(O)[C@@H]6C)[C@@H]5O)OC(CO)[C@@H](O)[C@@H]4O)O[C@H]3CO)[C@@H](O)C(O)[C@H]2O)(C(=O)O)C[C@H]1O

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SIGLEC7 Q9Y286 6/20 0.59
▸ MAG P20916 8/20 0.53
▸ SELP P16109 2/20 0.51
▸ SELL P14151 1/20 0.51
▸ CD209 Q9NNX6 1/20 0.46
▸ SELE P16581 2/20 0.45

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
SCHEMBL16350798 0.93 SIGLEC7 (0.60) SIGLEC7MAGSELPSELLCD209
SCHEMBL16350678 0.92 SIGLEC7 (0.55) SIGLEC7MAGSELPSELLSELE
SCHEMBL16350797 0.91 SIGLEC7 (0.63) SIGLEC7MAGSELPSELLSELE
SCHEMBL16350744 0.90 SIGLEC7 (0.63) SIGLEC7MAGSELPSELLSELE
SCHEMBL16350677 0.89 SIGLEC7 (0.53) SIGLEC7MAGSELPSELLSELE
SCHEMBL16316060 0.89 SIGLEC7 (0.52) SIGLEC7MAGSELPSELLSELE
SCHEMBL14331790 0.87 SIGLEC7 (0.60) SIGLEC7MAGSELPSELLCD209
SCHEMBL2629581 0.87 SIGLEC7 (0.60) SIGLEC7MAGSELPSELLCD209
SCHEMBL13004057 0.87 SIGLEC7 (0.60) SIGLEC7MAGSELPSELLCD209
SCHEMBL12404499 0.86 SIGLEC7 (0.61) SIGLEC7MAGSELPSELLCD209

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-7851618-B2 Aminated complex-type sugar chain derivatives and process for the production thereof OTSUKA CHEMICAL CO., LTD. (JP) 2010-12-14 — — US disclosed
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