SCHEMBL31139964

CC(=O)N[C@H]1[C@H](OC[C@H]2OC(O)[C@H](NC(C)=O)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H]4NC(C)=O)[C@H]3O)[C@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O

nearest known ligand 0.61

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	LGALS3	P17931	5/20	0.61

▸	LGALS8	O00214	1/20	0.61

▸	LGALS4	P56470	1/20	0.61

▸	MAPK1	P28482	2/20	0.50

▸	CD209	Q9NNX6	2/20	0.47

▸	CD69	Q07108	1/20	0.47

▸	CHIA	Q9BZP6	1/20	0.47

▸	ENGASE	Q8NFI3	1/20	0.47

▸	LGALS1	P09382	1/20	0.46

▸	LGALS7; LGALS7B	P47929	1/20	0.46

▸	AMY2A	P04746	2/20	0.44

▸	HPSE	Q9Y251	2/20	0.44

▸	ALDH1A1	P00352	1/20	0.43

▸	THRB	P10828	1/20	0.43

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
SCHEMBL30185407	1.00	LGALS3 (0.61)	LGALS3LGALS8LGALS4MAPK1CD209
SCHEMBL30185426	0.98	LGALS3 (0.63)	LGALS3LGALS8LGALS4MAPK1CD209
SCHEMBL29407986	0.97	LGALS3 (0.64)	LGALS3LGALS8LGALS4MAPK1CD209
SCHEMBL29532287	0.96	LGALS3 (0.61)	LGALS3LGALS8LGALS4MAPK1CD209
SCHEMBL31700328	0.96	LGALS3 (0.61)	LGALS3LGALS8LGALS4MAPK1CD209
SCHEMBL30267118	0.96	LGALS3 (0.63)	LGALS3LGALS8LGALS4MAPK1CD209
SCHEMBL30185411	0.96	LGALS3 (0.66)	LGALS3LGALS8LGALS4MAPK1CD209
SCHEMBL13577686	0.96	LGALS3 (0.66)	LGALS3LGALS8LGALS4MAPK1CD209
SCHEMBL13855946	0.96	LGALS3 (0.66)	LGALS3LGALS8LGALS4MAPK1CD209
SCHEMBL26491880	0.96	LGALS3 (0.66)	LGALS3LGALS8LGALS4MAPK1CD209

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-20240327888-A1	LACTO-N-BIOSE CONVERTING FUCOSYLTRANSFERASES	INBIOSE N.V. (BE)	2024-10-03	—	—	US	disclosed