SCHEMBL7119976

SCHEMBL7119976

CC(=O)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](O)(C(=O)O[C@H]2[C@@H](O)[C@H](n3ccc(N)nc3=O)O[C@@H]2[14CH2]OP(=O)(O)O)C[C@@H]1O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NANP Q8TBE9 3/20 0.39
ST6GAL1 P15907 5/20 0.38
NT5E P21589 1/20 0.36
MAG P20916 1/20 0.35
SIGLEC7 Q9Y286 1/20 0.34
POLA1 P09884 1/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
MTOR P42345 1/20 0.34
MDM2 Q00987 1/20 0.34
NCOA1 Q15788 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34

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
SCHEMBL237564 0.88 ST6GAL1 (0.45) NANPST6GAL1POLA1
SCHEMBL7023317 0.82 ST6GAL1 (0.41) NANPST6GAL1MAGLMNATHRB
SCHEMBL19423350 0.82 ST6GAL1 (0.42) ST6GAL1LMNATHRBMTORMDM2
Sialic Acid SCHEMBL29668373 0.81 ST6GAL1 (0.50) NANPST6GAL1
Sialic Acid SCHEMBL2296552 0.81 ST6GAL1 (0.50) NANPST6GAL1
Cytarabine 5'-Phosphate SCHEMBL5094677 0.81 ST6GAL1 (0.50) ST6GAL1
Sialic Acid SCHEMBL30081458 0.81 ST6GAL1 (0.50) NANPST6GAL1
Sialic Acid SCHEMBL21068057 0.81 ST6GAL1 (0.50) NANPST6GAL1
Sialic Acid SCHEMBL30081457 0.81 ST6GAL1 (0.50) NANPST6GAL1
Sialic Acid SCHEMBL28033676 0.80 LMNA (0.49) NANPST6GAL1NT5EMAGLMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6569649-B2 Providing acceptor moiety; preparing a glycosyltransferase specific for acceptor moiety and capable of transferring a saccharide unit; contacting acceptor moiety with glycosyltransferase; providing reaction condition and reagent THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2003-05-27 US disclosed
US-5441932-A Antiallergens, antiinflammatory agents JAPAN TOBACCO, INC. (JP) 1995-08-15 US disclosed
EP-0561523-A2 Sugar compound, sialic acid-containing sugar chains' biosynthesis inhibitor, production process thereof and intermediate Japan Tobacco Inc. (JP) 1993-09-22 EP disclosed