SCHEMBL10106219

SCHEMBL10106219

CCCCO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O)C(O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO)[C@H](O)C(O)C4O)C(O)C3NC(C)=O)C2O)C(O)C1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 6/20 0.69
LGALS8 O00214 2/20 0.69
LGALS4 P56470 2/20 0.69
MAPK1 P28482 1/20 0.62
CD69 Q07108 1/20 0.47
CHIA Q9BZP6 1/20 0.47
BMP2 P12643 2/20 0.46
VEGFA P15692 2/20 0.46
CXCL12 P48061 2/20 0.46
SHH Q15465 2/20 0.46
CD209 Q9NNX6 1/20 0.46
ALDH1A1 P00352 1/20 0.46
THRB P10828 1/20 0.46
IFNG P01579 1/20 0.46
PF4 P02776 1/20 0.46
CCL2 P13500 1/20 0.46
SELP P16109 1/20 0.46
BMP6 P22004 1/20 0.46
CCL11 P51671 1/20 0.46
WNT3A P56704 1/20 0.46

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
SCHEMBL15081918 1.00 LGALS3 (0.69) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL18947590 0.94 MAPK1 (0.71) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL19398451 0.92 LGALS8 (0.66) LGALS3LGALS8LGALS4MAPK1BMP2
SCHEMBL21851468 0.91 LGALS3 (0.68) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL18947591 0.91 MAPK1 (0.76) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL21134121 0.91 LGALS3 (0.62) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL25898876 0.90 LGALS3 (0.65) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL15079024 0.89 LGALS8 (0.61) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL15028632 0.89 MAPK1 (0.71) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL18122370 0.89 LGALS3 (0.66) LGALS3LGALS8LGALS4MAPK1CD69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012127410-A1 SYNTHESIS OF NEW FUCOSE-CONTAINING CARBOHYDRATE DERIVATIVES GLYCOM A/S (DK) 2012-09-27 WO disclosed
WO-2012007588-A1 SYNTHESIS OF NEW SIALOOLIGOSACCHARIDE DERIVATIVES GLYCOM A/S (DK) 2012-01-19 WO disclosed