SCHEMBL9472986

CCCCCCCCCCC[C@H](CC(=O)N[C@H]1[C@@H](OP(=O)(OCc2ccccc2)OCc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1OC(=O)C[C@@H](CCCCCCCCCCC)OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	TLR4	O00206	18/20	0.54

▸	LY96	Q9Y6Y9	4/20	0.43

▸	LGALS8	O00214	1/20	0.41

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
SCHEMBL9472989	0.90	TLR4 (0.46)	TLR4LY96
SCHEMBL9325154	0.90	TLR4 (0.61)	TLR4LY96
SCHEMBL9624577	0.87	TLR4 (0.51)	TLR4LGALS8
SCHEMBL9624581	0.87	TLR4 (0.51)	TLR4LGALS8
SCHEMBL9786197	0.86	TLR4 (0.49)	TLR4LGALS8
SCHEMBL9786193	0.86	TLR4 (0.49)	TLR4LGALS8
SCHEMBL9324146	0.86	TLR4 (0.48)	TLR4LY96
SCHEMBL2312622	0.84	TLR4 (0.54)	TLR4
SCHEMBL9518934	0.84	TLR4 (0.49)	TLR4LGALS8
SCHEMBL7714522	0.83	TLR4 (0.56)	TLR4LY96

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-5219843-A	Saccharide derivatives	SANDOZ LTD. (CH)	1993-06-15	—	—	US	disclosed