SCHEMBL17300130

SCHEMBL17300130

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

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 2/20 0.62
▸ SELL P14151 1/20 0.62
▸ MAG P20916 9/20 0.62
▸ SIGLEC7 Q9Y286 6/20 0.60
▸ NANP Q8TBE9 1/20 0.52
▸ SELE P16581 1/20 0.47

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
SCHEMBL29396615 1.00 SELP (0.62) SELPSELLMAGSIGLEC7NANP
SCHEMBL29356627 1.00 SELP (0.62) SELPSELLMAGSIGLEC7NANP
SCHEMBL29533149 0.95 SELL (0.62) SELPSELLMAGSIGLEC7NANP
SCHEMBL29425234 0.95 SELL (0.62) SELPSELLMAGSIGLEC7NANP
SCHEMBL29454806 0.95 SIGLEC7 (0.66) SELPSELLMAGSIGLEC7NANP
SCHEMBL29393136 0.95 SIGLEC7 (0.66) SELPSELLMAGSIGLEC7NANP
SCHEMBL29355980 0.95 SIGLEC7 (0.66) SELPSELLMAGSIGLEC7NANP
SCHEMBL30483871 0.94 SIGLEC7 (0.65) SELPSELLMAGSIGLEC7NANP
SCHEMBL29732819 0.94 SIGLEC7 (0.65) SELPSELLMAGSIGLEC7NANP
SCHEMBL29432515 0.94 SELL (0.68) SELPSELLMAGSIGLEC7NANP

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
WO-2015184442-A1 ELECTROCHEMICAL METHODS AND COMPOUNDS FOR THE DETECTION OF ENZYMES GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION (US) 2015-12-03 — — WO disclosed
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