SCHEMBL17300136

SCHEMBL17300136

COC(=O)[C@@]1(OCC2O[C@H](O)C(O)[C@@H](O)[C@@H]2O)C[C@@H](O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAG P20916 6/20 0.56
▸ NANP Q8TBE9 2/20 0.54
▸ SIGLEC7 Q9Y286 2/20 0.51
▸ SELL P14151 1/20 0.49
▸ SELP P16109 1/20 0.49
▸ CD22 P20273 10/20 0.48

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
SCHEMBL29437857 0.93 SIGLEC7 (0.57) MAGNANPSIGLEC7SELLSELP
SCHEMBL29397098 0.93 SIGLEC7 (0.57) MAGNANPSIGLEC7SELLSELP
SCHEMBL29437858 0.93 SIGLEC7 (0.57) MAGNANPSIGLEC7SELLSELP
SCHEMBL31309218 0.93 SIGLEC7 (0.57) MAGNANPSIGLEC7SELLSELP
SCHEMBL29883057 0.93 SIGLEC7 (0.57) MAGNANPSIGLEC7SELLSELP
SCHEMBL15177450 0.87 SIGLEC7 (0.55) MAGNANPSIGLEC7SELLSELP
SCHEMBL29410578 0.87 SIGLEC7 (0.55) MAGNANPSIGLEC7SELLSELP
SCHEMBL16298815 0.87 SIGLEC7 (0.55) MAGNANPSIGLEC7SELLSELP
SCHEMBL29732933 0.87 SIGLEC7 (0.55) MAGNANPSIGLEC7SELLSELP
SCHEMBL29352702 0.87 SIGLEC7 (0.55) MAGNANPSIGLEC7SELLSELP

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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