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Sugi Predict / Compounds / SCHEMBL25121374

SCHEMBL25121374

SCHEMBL25121374

CC(=O)NC1C(OC2C(CO)OC(OC3C(CO)OC(C)C(O)C3O)C(O)C2O[C@]2(C(=O)O)C[C@@H](O)C(NC(C)=O)C([C@H](O)[C@H](O)CO)O2)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1O

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 2/20 0.71
▸ SELL P14151 2/20 0.71
▸ SIGLEC7 Q9Y286 6/20 0.64
▸ MAG P20916 6/20 0.63
▸ SELE P16581 4/20 0.61

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
SCHEMBL29532526 0.95 SELP (0.71) SELPSELLSIGLEC7MAGSELE
SCHEMBL31700337 0.95 SELP (0.71) SELPSELLSIGLEC7MAGSELE
SCHEMBL31701520 0.95 SELP (0.72) SELPSELLSIGLEC7MAGSELE
SCHEMBL31700925 0.95 SELP (0.72) SELPSELLSIGLEC7MAGSELE
SCHEMBL21250707 0.95 SELP (0.67) SELPSELLSIGLEC7MAGSELE
SCHEMBL31701004 0.95 SELP (0.70) SELPSELLSIGLEC7MAGSELE
SCHEMBL30653953 0.94 SELP (0.67) SELPSELLSIGLEC7MAGSELE
SCHEMBL29532946 0.94 SELP (0.67) SELPSELLSIGLEC7MAGSELE
SCHEMBL25124354 0.94 SELP (0.70) SELPSELLSIGLEC7MAGSELE
SCHEMBL27420909 0.94 SELP (0.70) SELPSELLSIGLEC7MAGSELE

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-20230094369-A1 SYNTHESIS OF GLYCOSYLATED SPHINGOID BASES OF INTEREST OR ANALOGUES THEREOF CARBOCODE S A (PT) 2023-03-30 — — US disclosed
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