SCHEMBL4284548

SCHEMBL4284548

[CH2][C@@]1(O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NANP Q8TBE9 3/20 0.53
L3MBTL1 Q9Y468 1/20 0.47
NEU2 Q9Y3R4 3/20 0.46
NEU4 Q8WWR8 2/20 0.46
NEU3 Q9UQ49 2/20 0.46
NEU1 Q99519 1/20 0.46
SELL P14151 1/20 0.42
SELP P16109 1/20 0.42
MAG P20916 2/20 0.41
SIGLEC7 Q9Y286 1/20 0.41

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
SCHEMBL123104 1.00 NANP (0.53) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL4943493 0.88 L3MBTL1 (0.42) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL468825 0.86 NANP (0.54) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL13926096 0.86 NANP (0.54) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL15491955 0.86 NANP (0.54) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL8675353 0.86 NANP (0.49) NANPNEU1SELLSELPMAG
Sialic Acid SCHEMBL30437228 0.85 NANP (0.71) NANPL3MBTL1NEU2NEU4NEU3
Sialic Acid SCHEMBL19664236 0.85 NANP (0.71) NANPL3MBTL1NEU2NEU4NEU3
Sialic Acid SCHEMBL17963743 0.85 NANP (0.71) NANPL3MBTL1NEU2NEU4NEU3
SCHEMBL12391931 0.85 NANP (0.53) NANPL3MBTL1NEU2NEU4NEU3

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-20090203547-A1 Gene and Cognate Protein Profiles and Methods to Determine Connective Tissue Markers in Normal and Pathologic Conditions UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL, THE 2009-08-13 US disclosed