SCHEMBL12736613

C#CC#CC#COCC1O[C@@H](O[C@H]2C(O)C(O)[C@H](O[C@@H]3C(COCCO)O[C@@H](O[C@H]4C(O)C(O)[C@H](O)O[C@H]4CO)C(OCCO)[C@H]3O)O[C@H]2COCCOCCCCCCCCCCCCCCCC)C(O)[C@@H](O)[C@@H]1O

nearest known ligand 0.43

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	GJB2	P29033	5/20	0.43

▸	LGALS3	P17931	4/20	0.38

▸	LGALS8	O00214	3/20	0.38

▸	LGALS4	P56470	3/20	0.38

▸	ENGASE	Q8NFI3	1/20	0.35

▸	AMY2A	P04746	4/20	0.34

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
SCHEMBL17688997	0.95	GJB2 (0.41)	GJB2LGALS3LGALS8LGALS4ENGASE
SCHEMBL17688996	0.83	GJB2 (0.50)	GJB2LGALS3LGALS8LGALS4ENGASE
SCHEMBL12736606	0.82	GJB2 (0.47)	GJB2LGALS3LGALS8LGALS4ENGASE
SCHEMBL17688998	0.79	LGALS8 (0.52)	GJB2LGALS3LGALS8LGALS4AMY2A
SCHEMBL412539	0.79	LGALS8 (0.54)	GJB2LGALS3LGALS8LGALS4ENGASE
SCHEMBL9804026	0.79	LGALS8 (0.54)	GJB2LGALS3LGALS8LGALS4ENGASE
SCHEMBL12736611	0.78	GJB2 (0.45)	GJB2LGALS3LGALS8LGALS4ENGASE
SCHEMBL7619250	0.76	LGALS8 (0.62)	GJB2LGALS3LGALS8LGALS4AMY2A
SCHEMBL14327697	0.76	AMY2A (0.41)	GJB2LGALS3LGALS8LGALS4AMY2A
SCHEMBL4990033	0.75	LGALS8 (0.50)	GJB2LGALS3LGALS8LGALS4ENGASE

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-9315715-B2	Method of reducing the viscosity of hydrocarbons	NALCO COMPANY (US)	2016-04-19	—	—	US	disclosed
US-20110092393-A1	METHOD OF REDUCING THE VISCOSITY OF HYDROCARBONS	APERGY ESP SYSTEMS, LLC	2011-04-21	—	—	US	disclosed