SCHEMBL30267455

CC(=O)N[C@H]1[C@@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]3CO)[C@@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@H](O)[C@@H]1O

nearest known ligand 0.56

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	LGALS3	P17931	6/20	0.56

▸	LGALS8	O00214	1/20	0.56

▸	LGALS4	P56470	1/20	0.56

▸	CD69	Q07108	1/20	0.49

▸	CHIA	Q9BZP6	1/20	0.49

▸	MAPK1	P28482	2/20	0.47

▸	AMY2A	P04746	3/20	0.47

▸	ALDH1A1	P00352	1/20	0.46

▸	THRB	P10828	1/20	0.46

▸	LGALS9	O00182	1/20	0.45

▸	LGALS1	P09382	1/20	0.44

▸	LGALS7; LGALS7B	P47929	1/20	0.44

▸	AMY1A	P0DUB6	1/20	0.44

▸	GAA	P10253	1/20	0.42

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.

Compound	similarity	top predicted	shared targets
SCHEMBL29532739	1.00	LGALS3 (0.56)	LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL30565919	1.00	LGALS3 (0.56)	LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL29532634	0.97	LGALS3 (0.56)	LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL29912771	0.95	LGALS3 (0.55)	LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL29632864	0.95	LGALS3 (0.55)	LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL30564573	0.95	MAPK1 (0.53)	LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL29407990	0.95	LGALS3 (0.56)	LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL31700321	0.94	LGALS3 (0.55)	LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL31700821	0.94	LGALS3 (0.55)	LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL31701501	0.94	LGALS3 (0.55)	LGALS3LGALS8LGALS4CD69CHIA

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20230279403-A1	PRODUCTION OF ALPHA-1,3 GLYCOSYLATED FORM OF FUC-A1,2-GAL-R	INBIOSE N.V. (BE)	2023-09-07	—	—	US	disclosed