SCHEMBL14331790

SCHEMBL14331790

CC(=O)NC1C(NC(=O)CC(N)C(=O)O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)[C@@H](OC5OC(COC6(C(=O)O)C[C@@H](O)C(NC(C)=O)C([C@H](O)C(O)CO)O6)C(O)C(O)C5O)C(O)C4NC(C)=O)C(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(OC5OC(COC6(C(=O)O)C[C@@H](O)C(NC(C)=O)C([C@H](O)C(O)CO)O6)C(O)C(O)C5O)C(O)C4NC(C)=O)C3O)C(O)C2NC(C)=O)C1O

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SIGLEC7 Q9Y286 6/20 0.60
▸ MAG P20916 8/20 0.56
▸ CD209 Q9NNX6 1/20 0.56
▸ SELP P16109 2/20 0.50
▸ SELL P14151 1/20 0.50
▸ 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
SCHEMBL13004057 1.00 SIGLEC7 (0.60) SIGLEC7MAGCD209SELPSELL
SCHEMBL2629581 1.00 SIGLEC7 (0.60) SIGLEC7MAGCD209SELPSELL
SCHEMBL14570809 0.97 SIGLEC7 (0.58) SIGLEC7MAGCD209SELPSELL
SCHEMBL13415599 0.93 SIGLEC7 (0.56) SIGLEC7MAGCD209SELPSELL
SCHEMBL12404499 0.93 SIGLEC7 (0.61) SIGLEC7MAGCD209SELPSELL
SCHEMBL13004060 0.90 SIGLEC7 (0.63) SIGLEC7MAGSELPSELLSELE
SCHEMBL13004041 0.90 SIGLEC7 (0.65) SIGLEC7MAGSELPSELLSELE
SCHEMBL30532209 0.90 SIGLEC7 (0.65) SIGLEC7MAGSELPSELLSELE
SCHEMBL14570812 0.90 SIGLEC7 (0.60) SIGLEC7MAGCD209SELPSELL
SCHEMBL14416233 0.90 SIGLEC7 (0.58) SIGLEC7MAGCD209SELPSELL

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-7304148-B2 Sugar chain asparagine derivatives, sugar chain asparagine, sugar chain, and processes for producing these OTSUKA CHEMICAL CO., LTD. (JP) 2007-12-04 — — US disclosed
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