SCHEMBL11015903

SCHEMBL11015903

CCCCCCCCCCCCCCCCN[C@@H]1[C@@H](OCc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.48
▸ SLC6A2 P23975 1/20 0.44
▸ SSTR5 P35346 1/20 0.44
▸ GBA1 P04062 8/20 0.43
▸ SELP P16109 1/20 0.42
▸ LGALS8 O00214 1/20 0.41

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
SCHEMBL10958757 0.85 MAPK1 (0.55) MAPK1SSTR5SELP
SCHEMBL10958752 0.85 MAPK1 (0.55) MAPK1SSTR5SELP
SCHEMBL10881696 0.81 MAPK1 (0.66) MAPK1GBA1LGALS8
SCHEMBL10881693 0.81 MAPK1 (0.66) MAPK1GBA1LGALS8
SCHEMBL21058378 0.80 CA1 (0.48) MAPK1SLC6A2SSTR5LGALS8
SCHEMBL9233052 0.79 OGA (0.49) LGALS8
SCHEMBL9233060 0.79 OGA (0.49) LGALS8
SCHEMBL9231776 0.79 GBA1 (0.54) MAPK1GBA1LGALS8
SCHEMBL9231772 0.79 GBA1 (0.54) MAPK1GBA1LGALS8
SCHEMBL9746699 0.78 LGALS8 (0.42) MAPK1LGALS8

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
US-4495346-A CATALYTICALLY COUPLING TWO MONOSACCHARIDES WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1985-01-22 — — US disclosed
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