SCHEMBL8401450

COC(=O)CCCCCCCCO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)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 0.57

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	BDNF	P23560	3/20	0.57

▸	MDK	P21741	3/20	0.57

▸	PTN	P21246	2/20	0.57

▸	LGALS8	O00214	1/20	0.49

▸	LGALS3	P17931	1/20	0.49

▸	LGALS4	P56470	1/20	0.49

▸	SELE	P16581	3/20	0.48

▸	SELL	P14151	3/20	0.41

▸	MAPK1	P28482	1/20	0.41

▸	F9	P00740	2/20	0.41

▸	SELP	P16109	3/20	0.40

▸	BMP2	P12643	2/20	0.40

▸	VEGFA	P15692	2/20	0.40

▸	CXCL12	P48061	2/20	0.40

▸	SHH	Q15465	2/20	0.40

▸	IFNG	P01579	1/20	0.40

▸	PF4	P02776	1/20	0.40

▸	CCL2	P13500	1/20	0.40

▸	BMP6	P22004	1/20	0.40

▸	CCL11	P51671	1/20	0.40

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
SCHEMBL8401789	0.93	LGALS8 (0.53)	BDNFMDKPTNLGALS8LGALS3
SCHEMBL9057973	0.92	LGALS8 (0.54)	BDNFMDKPTNLGALS8LGALS3
SCHEMBL8594065	0.91	VEGFA (0.49)	BDNFMDKPTNLGALS8LGALS3
SCHEMBL8403298	0.91	VEGFA (0.49)	BDNFMDKPTNLGALS8LGALS3
SCHEMBL8399860	0.91	LGALS8 (0.53)	BDNFMDKPTNLGALS8LGALS3
SCHEMBL8397629	0.91	LGALS8 (0.51)	BDNFMDKPTNLGALS8LGALS3
SCHEMBL8398092	0.89	LGALS8 (0.51)	BDNFMDKPTNLGALS8LGALS3
SCHEMBL8398157	0.88	SELE (0.50)	BDNFMDKPTNLGALS8LGALS3
SCHEMBL8398199	0.88	SELE (0.50)	BDNFMDKPTNLGALS8LGALS3
SCHEMBL8401253	0.88	LGALS8 (0.52)	BDNFMDKPTNLGALS8LGALS3

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-5874411-A	ANTIINFLAMMATORY	GLYCOMED INCORPORATED (US)	1999-02-23	—	—	US	claimed
US-5874411-A	ANTIINFLAMMATORY	GLYCOMED INCORPORATED (US)	1999-02-23	—	—	US	disclosed