SCHEMBL16433509

CCCCCCCC/C=C\CCCCCCCC(=O)N[C@H]1[C@H](O[C@H]2C(O)[C@@H](NC(C)=O)[C@H](O[C@H]3[C@H](O)[C@@H](NC(C)=O)[C@H](O[C@H]4C(O)[C@@H](NC(C)=O)[C@H](C)O[C@@H]4COS(=O)(=O)O)O[C@@H]3CO)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.46

Predicted protein targets (top 19)

	gene	UniProt	supporting neighbours	confidence
▸	MAPK1	P28482	1/20	0.46

▸	TLR4	O00206	5/20	0.46

▸	LGALS8	O00214	1/20	0.43

▸	LGALS3	P17931	1/20	0.43

▸	LGALS4	P56470	1/20	0.43

▸	BMP2	P12643	2/20	0.43

▸	VEGFA	P15692	2/20	0.43

▸	CXCL12	P48061	2/20	0.43

▸	SHH	Q15465	2/20	0.43

▸	SELP	P16109	8/20	0.42

▸	CHIA	Q9BZP6	1/20	0.41

▸	CD69	Q07108	1/20	0.41

▸	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

▸	WNT3A	P56704	1/20	0.40

▸	SELPLG	Q14242	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
SCHEMBL19220671	1.00	MAPK1 (0.46)	MAPK1TLR4LGALS8LGALS3LGALS4
SCHEMBL22098472	0.95	MAPK1 (0.50)	MAPK1TLR4LGALS8LGALS3LGALS4
SCHEMBL16433508	0.95	MAPK1 (0.50)	MAPK1TLR4LGALS8LGALS3LGALS4
SCHEMBL16800387	0.95	MAPK1 (0.50)	MAPK1TLR4LGALS8LGALS3LGALS4
SCHEMBL19220663	0.95	TLR4 (0.43)	MAPK1TLR4LGALS8LGALS3LGALS4
SCHEMBL23773084	0.93	MAPK1 (0.47)	MAPK1TLR4LGALS8LGALS3LGALS4
SCHEMBL21888384	0.93	MAPK1 (0.47)	MAPK1TLR4LGALS8LGALS3LGALS4
SCHEMBL21565221	0.93	MAPK1 (0.47)	MAPK1TLR4LGALS8LGALS3LGALS4
SCHEMBL20685523	0.93	MAPK1 (0.47)	MAPK1TLR4LGALS8LGALS3LGALS4
SCHEMBL19220659	0.93	MAPK1 (0.47)	MAPK1TLR4LGALS8LGALS3LGALS4

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-8946119-B2	Chitooligosaccharides and methods for use in enhancing soybean growth	NOVOZYMES BIOAG A/S (DK)	2015-02-03	—	—	US	disclosed