SCHEMBL7779161

SCHEMBL7779161

CCCCCCCCOC1O[C@H](CO)[C@](O)([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
LGALS8 O00214 1/20 0.41
LGALS3 P17931 1/20 0.41
LGALS4 P56470 1/20 0.41
CETP P11597 1/20 0.39
GJB2 P29033 1/20 0.38
GBA1 P04062 1/20 0.38

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
SCHEMBL5270189 0.94 MAPK1 (0.42) MAPK1LGALS8LGALS3LGALS4CETP
SCHEMBL11102462 0.88 MAPK1 (0.37) MAPK1LGALS8LGALS3LGALS4CETP
SCHEMBL14941388 0.84 ADORA2A (0.38) MAPK1LGALS8LGALS3LGALS4
SCHEMBL10867612 0.80 MGAM (0.38) LGALS8
SCHEMBL23016771 0.79 MAPK1 (0.65) MAPK1LGALS8LGALS3LGALS4CETP
SCHEMBL21067398 0.79 MAPK1 (0.65) MAPK1LGALS8LGALS3LGALS4CETP
SCHEMBL2448675 0.79 MAPK1 (0.65) MAPK1LGALS8LGALS3LGALS4CETP
SCHEMBL22111992 0.79 MAPK1 (0.65) MAPK1LGALS8LGALS3LGALS4CETP
SCHEMBL22691938 0.79 MAPK1 (0.65) MAPK1LGALS8LGALS3LGALS4CETP
SCHEMBL333089 0.79 MAPK1 (0.65) MAPK1LGALS8LGALS3LGALS4CETP

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
EP-0827549-B1 METHOD FOR THE ENZYMATIC GALACTOSYLATION OF MONOSACCHARIDES AND OLIGOSACCHARIDES AVENTIS RES & TECH GMBH & CO (DE) 2001-09-26 EP disclosed
US-5962275-A ADDING DEOXYNUCLEOSIDE DIPHOSPHATE KETOSUGAR, GALACTOSONE, ALLOSONE, GLUCOSONE OR 6-DEOXYGLYCOSONE TO REACTION MIXTURE AS ACTIVATOR OF URIDINE DIPHOSPHATE-GLUCOSE 4'-EPIMERASE HOECHST AKTIENGESELLSCHAFT (DE) 1999-10-05 US disclosed