SCHEMBL8398199

COC(=O)CCCCCCCCO[C@@H]1O[C@H](CN)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](OS(=O)(=O)O)[C@H]2O)[C@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]1NC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 17)

	gene	UniProt	supporting neighbours	confidence
▸	SELE	P16581	6/20	0.50

▸	LGALS8	O00214	2/20	0.49

▸	LGALS3	P17931	2/20	0.49

▸	LGALS4	P56470	2/20	0.49

▸	BDNF	P23560	3/20	0.46

▸	PTN	P21246	2/20	0.46

▸	MDK	P21741	2/20	0.46

▸	MAPK1	P28482	1/20	0.43

▸	SELL	P14151	3/20	0.43

▸	SELP	P16109	2/20	0.43

▸	IFNG	P01579	1/20	0.36

▸	FGF1	P05230	1/20	0.36

▸	FGF2	P09038	1/20	0.36

▸	BMP2	P12643	1/20	0.36

▸	VEGFA	P15692	1/20	0.36

▸	SFRP1	Q8N474	1/20	0.36

▸	TLR4	O00206	1/20	0.35

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
SCHEMBL9057973	0.96	LGALS8 (0.54)	SELELGALS8LGALS3LGALS4BDNF
SCHEMBL8397776	0.94	SELE (0.51)	SELELGALS8LGALS3LGALS4BDNF
SCHEMBL8401789	0.93	LGALS8 (0.53)	SELELGALS8LGALS3LGALS4BDNF
SCHEMBL8398157	0.93	SELE (0.50)	SELELGALS8LGALS3LGALS4BDNF
SCHEMBL8398092	0.93	LGALS8 (0.51)	SELELGALS8LGALS3LGALS4BDNF
SCHEMBL8399860	0.92	LGALS8 (0.53)	SELELGALS8LGALS3LGALS4BDNF
SCHEMBL8401253	0.91	LGALS8 (0.52)	SELELGALS8LGALS3LGALS4BDNF
SCHEMBL8399868	0.90	LGALS3 (0.49)	SELELGALS8LGALS3LGALS4BDNF
SCHEMBL8397629	0.90	LGALS8 (0.51)	SELELGALS8LGALS3LGALS4BDNF
SCHEMBL8831331	0.89	LGALS3 (0.55)	SELELGALS8LGALS3LGALS4BDNF

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-5874411-A	ANTIINFLAMMATORY	GLYCOMED INCORPORATED (US)	1999-02-23	—	—	US	disclosed