SCHEMBL2323889

SCHEMBL2323889

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.34
SLCO1B1 Q9Y6L6 1/20 0.34
AKR1B1 P15121 1/20 0.33
CYP2D6 P10635 2/20 0.32
LMNA P02545 2/20 0.32
SPHK1 Q9NYA1 1/20 0.32
GMNN O75496 1/20 0.32
POLB P06746 1/20 0.32
THPO P40225 1/20 0.32
MTOR P42345 1/20 0.32
BLM P54132 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
CETP P11597 1/20 0.32
HTT P42858 1/20 0.32
UBE2N P61088 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11402894 0.82 LMNA (0.43) USP2SLCO1B1AKR1B1LMNAKDM4E
SCHEMBL11656356 0.82 LMNA (0.43) USP2SLCO1B1AKR1B1LMNAKDM4E
Deoxyglucose SCHEMBL148114 0.78 LMNA (0.50) USP2SLCO1B1AKR1B1LMNAKDM4E
Deoxyglucose SCHEMBL2065929 0.78 LMNA (0.50) USP2SLCO1B1AKR1B1LMNAKDM4E
Deoxyglucose SCHEMBL2315642 0.78 LMNA (0.50) USP2SLCO1B1AKR1B1LMNAKDM4E
Deoxyglucose SCHEMBL200714 0.78 LMNA (0.50) USP2SLCO1B1AKR1B1LMNAKDM4E
Deoxyglucose SCHEMBL120125 0.78 LMNA (0.50) USP2SLCO1B1AKR1B1LMNAKDM4E
Deoxyglucose SCHEMBL4480352 0.78 LMNA (0.50) USP2SLCO1B1AKR1B1LMNAKDM4E
Deoxyglucose SCHEMBL3019708 0.78 LMNA (0.50) USP2SLCO1B1AKR1B1LMNAKDM4E
Deoxyglucose SCHEMBL10386937 0.78 LMNA (0.50) USP2SLCO1B1AKR1B1LMNAKDM4E

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 4 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-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