SCHEMBL10418919

CCCCCCCCCCC[C@@H](CC(=O)N[C@H]1[C@H](OCc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1OC(=O)CCCCCCCc1ccc(OC)cc1)OC(=O)CCCCCCCc1ccc(OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	TLR4	O00206	15/20	0.51

▸	SELP	P16109	1/20	0.41

▸	MCHR1	Q99705	2/20	0.40

▸	SSTR2	P30874	2/20	0.40

▸	SSTR3	P32745	2/20	0.40

▸	SSTR5	P35346	2/20	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
SCHEMBL10418883	0.96	TLR4 (0.54)	TLR4SELPMCHR1
SCHEMBL8431958	0.95	TLR4 (0.54)	TLR4SELP
SCHEMBL8436288	0.95	TLR4 (0.54)	TLR4SELP
SCHEMBL8431429	0.93	TLR4 (0.53)	TLR4SELPMCHR1
SCHEMBL6807623	0.93	TLR4 (0.57)	TLR4SELP
SCHEMBL6795483	0.93	TLR4 (0.57)	TLR4SELP
SCHEMBL6807622	0.93	TLR4 (0.57)	TLR4SELP
SCHEMBL6800991	0.93	TLR4 (0.57)	TLR4SELP
SCHEMBL8434749	0.92	TLR4 (0.49)	TLR4MCHR1SSTR2SSTR3SSTR5
SCHEMBL8432746	0.92	TLR4 (0.49)	TLR4MCHR1SSTR2SSTR3SSTR5

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-4925929-A	ANTITUMOR AGENTS	ONO PHARMACEUTICAL CO. LTD. (JP)	1990-05-15	—	—	US	disclosed