SCHEMBL2316111

SCHEMBL2316111

N[C@H](C=O)C[C@H](O)[C@@H](S)CO

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.36

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
SCHEMBL2318381 0.80 AKR1B1 (0.40) AKR1B1
SCHEMBL3202899 0.80 AKR1B1 (0.40) AKR1B1
SCHEMBL2316079 0.78 AKR1B1 (0.50) AKR1B1
SCHEMBL2316305 0.78 AKR1B1 (0.39) AKR1B1
SCHEMBL14151526 0.71
SCHEMBL2320378 0.71 AKR1B1 (0.32) AKR1B1
SCHEMBL18658774 0.70 SLC6A2 (0.34)
SCHEMBL7029257 0.69
SCHEMBL186706 0.69
SCHEMBL186707 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2150620-A2 METHOD FOR PREPARING C-6 PHOSPHORYLATED D-ALDOHEXOSES AND C-6 PHOSPHORYLATED D-ALDOHEXOSE DERIVATIVES, AND NEW C-6 PHOSPHORYLATED D-ALDOHEXOSE DERIVATIVES Libragen (FR) 2010-02-10 EP claimed
WO-2008142155-A2 METHOD FOR PREPARING C-6 PHOSPHORYLATED D-ALDOHEXOSES AND C-6 PHOSPHORYLATED D-ALDOHEXOSES DERIVATIVES AND NEW C-6 PHOSPHORYLATED D-ALDOHEXOSES DERIVATIVES LIBRAGEN (FR) 2008-11-27 WO claimed
EP-1995323-A1 Method for preparing C-6 phosphorylated D-aldohexoses and C-6 phosphorylated D-aldohexose derivatives Libragen (FR) 2008-11-26 EP claimed
EP-2150620-B1 Method for preparing C-6 phosphorylated D-aldohexoses and C-6 phosphorylated D-aldohexose derivatives, and new C-6 phosphorylated D-aldohexose derivatives LIBRAGEN (FR) 2011-08-10 EP disclosed
EP-1995323-A1 Method for preparing C-6 phosphorylated D-aldohexoses and C-6 phosphorylated D-aldohexose derivatives Libragen (FR) 2008-11-26 EP disclosed