SCHEMBL20193262

SCHEMBL20193262

CC(=O)NC1C([C@H](O)[C@H](O)CO)O[C@@](OCC(OC(OCCCCCN)[C@@H](O)CO)[C@@H](C)O)(C(=O)O)C[C@H]1C(OC(CO[C@]1(C(=O)O)C[C@@H](O)C(NC(C)=O)C([C@H](O)[C@H](O)CO)O1)[C@@H](C)O)[C@@H](O)CO

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NANP Q8TBE9 3/20 0.42
▸ SIGLEC7 Q9Y286 7/20 0.42
▸ CD22 P20273 2/20 0.39
▸ SELL P14151 1/20 0.38
▸ SELP P16109 1/20 0.38
▸ MAG P20916 2/20 0.38

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
SCHEMBL25588781 0.79 NANP (0.50) NANPSIGLEC7SELLSELPMAG
SCHEMBL30449055 0.76 NANP (0.57) NANPSIGLEC7CD22SELLSELP
SCHEMBL29226109 0.76 NANP (0.58) NANPSIGLEC7CD22SELLSELP
SCHEMBL29380848 0.74 NANP (0.48) NANPSIGLEC7CD22SELLSELP
SCHEMBL8472605 0.74 NANP (0.58) NANPSIGLEC7CD22SELLSELP
SCHEMBL1487630 0.74 NANP (0.58) NANPSIGLEC7CD22SELLSELP
SCHEMBL19490293 0.74 NANP (0.42) NANPSIGLEC7CD22SELLSELP
SCHEMBL23758914 0.74 NANP (0.54) NANPSIGLEC7CD22SELLSELP
SCHEMBL14750212 0.73 NANP (0.57) NANPSIGLEC7CD22SELLSELP
SCHEMBL17897325 0.72 SIGLEC7 (0.66) SIGLEC7CD22SELLSELPMAG

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-9981030-B2 Glycan conjugates and use thereof ACADEMIA SINICA (TW) 2018-05-29 — — US disclosed
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