SCHEMBL11102462

SCHEMBL11102462

CCCCCCCCCCCCCCCCCCSCCO[C@H]1O[C@H](CO)[C@](O)([C@@H]2O[C@H](CO)[C@@](O)([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.37
CETP P11597 1/20 0.34
LGALS8 O00214 1/20 0.32
LGALS3 P17931 1/20 0.32
LGALS4 P56470 1/20 0.32
PTPN1 P18031 1/20 0.31

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
SCHEMBL11100963 0.88 MAPK1 (0.52) MAPK1LGALS8LGALS3LGALS4
SCHEMBL7779161 0.88 MAPK1 (0.47) MAPK1CETPLGALS8LGALS3LGALS4
SCHEMBL5270189 0.84 MAPK1 (0.42) MAPK1CETPLGALS8LGALS3LGALS4
SCHEMBL11102005 0.83 GBA1 (0.35) MAPK1LGALS8LGALS3LGALS4
SCHEMBL10409976 0.80 MAPK1 (0.51) MAPK1CETPLGALS8LGALS3LGALS4
SCHEMBL10409977 0.80 MAPK1 (0.51) MAPK1CETPLGALS8LGALS3LGALS4
SCHEMBL10408578 0.80 MAPK1 (0.51) MAPK1CETPLGALS8LGALS3LGALS4
SCHEMBL13528358 0.75 MAPK1 (0.54) MAPK1CETPLGALS8LGALS3LGALS4
SCHEMBL5519212 0.75 MAPK1 (0.33) MAPK1
SCHEMBL11101157 0.75 MAPK1 (0.40) MAPK1LGALS8LGALS3LGALS4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0098252-A2 New and novel glycosides, glycoconjugates and processes for their preparation BIOCARB AB (SE) 1984-01-11 EP disclosed