SCHEMBL5199046

SCHEMBL5199046

CSC1OC(CC(C)C(N)=O)C(O)C(O)C1O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 6/20 0.38
LGALS1 P09382 2/20 0.36
LGALS9 O00182 1/20 0.36
LGALS8 O00214 1/20 0.36
SLC5A1 P13866 4/20 0.33
ALB P02768 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C9 P11712 1/20 0.32
SLC5A2 P31639 1/20 0.31
HTR2A P28223 1/20 0.31
ADRA1A P35348 1/20 0.31
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL5198276 0.86 LGALS3 (0.38) LGALS3LGALS1LGALS9LGALS8
SCHEMBL5199461 0.84 LGALS3 (0.38) LGALS3LGALS1LGALS9LGALS8SLC5A1
SCHEMBL5199523 0.84 LGALS3 (0.36) LGALS3LGALS1LGALS9LGALS8
SCHEMBL5196587 0.83 LGALS3 (0.38) LGALS3LGALS1LGALS9LGALS8SLC5A1
SCHEMBL5633189 0.80 LGALS3 (0.34) LGALS3LGALS1LGALS9LGALS8
SCHEMBL14435918 0.80 LGALS3 (0.42) LGALS3LGALS1LGALS9LGALS8ALB
SCHEMBL5197875 0.79 IDUA (0.33)
SCHEMBL5197001 0.79 PYGB (0.41) LGALS3LGALS1LGALS9LGALS8
SCHEMBL18892750 0.78 LGALS3 (0.41) LGALS3LGALS1LGALS9LGALS8ALB
SCHEMBL14435916 0.77 LGALS3 (0.40) LGALS3LGALS1LGALS9LGALS8SLC5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007516172-A 2007-06-21 JP claimed
EP-1654268-A2 LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2006-05-10 EP claimed
EP-1644393-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIMICROBIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2006-04-12 EP claimed
WO-2005012320-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIMICROBIAL ACTIVITY VICURON PHARMACEUTICALS, INC. (US) 2005-02-10 WO claimed
WO-2005007665-A2 LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2005-01-27 WO claimed
EP-1814893-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2007-08-08 EP disclosed
WO-2006055070-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2006-05-26 WO disclosed
EP-1654268-A2 LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2006-05-10 EP disclosed
EP-1644393-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIMICROBIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2006-04-12 EP disclosed
WO-2005012320-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIMICROBIAL ACTIVITY VICURON PHARMACEUTICALS, INC. (US) 2005-02-10 WO disclosed
WO-2005007665-A2 LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2005-01-27 WO disclosed