SCHEMBL18211306

SCHEMBL18211306

CC(=O)N[C@@H]1C(O)C[C@](OC2C(O)[C@H](O[C@@H]3C(CO)O[C@@H](O)C(C)[C@H]3O[C@@H]3OC(C)[C@@H](O)C(O)[C@@H]3O)OC(CO)[C@@H]2O)(C(=O)O)OC1[C@H](O)[C@H](O)CO

nearest known ligand 0.78

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 2/20 0.72
▸ SELL P14151 1/20 0.72
▸ SIGLEC7 Q9Y286 6/20 0.62
▸ MAG P20916 6/20 0.60
▸ SELE P16581 5/20 0.59

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
SCHEMBL18211295 1.00 SELP (0.72) SELPSELLSIGLEC7MAGSELE
SCHEMBL29372449 0.95 SELP (0.73) SELPSELLSIGLEC7MAGSELE
SCHEMBL29405702 0.95 SELP (0.73) SELPSELLSIGLEC7MAGSELE
SCHEMBL29448496 0.95 SELP (0.73) SELPSELLSIGLEC7MAGSELE
SCHEMBL29391699 0.95 SELP (0.73) SELPSELLSIGLEC7MAGSELE
SCHEMBL29389517 0.95 SELP (0.73) SELPSELLSIGLEC7MAGSELE
SCHEMBL13195877 0.95 SELP (0.73) SELPSELLSIGLEC7MAGSELE
SCHEMBL13978771 0.95 SELP (0.73) SELPSELLSIGLEC7MAGSELE
SCHEMBL31010809 0.94 SELP (0.71) SELPSELLSIGLEC7MAGSELE
SCHEMBL29407985 0.94 SELP (0.71) 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-9486497-B2 Treatment of immunocompromised conditions THE UNIVERSITY OF QUEENSLAND (AU) 2016-11-08 — — US disclosed
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