Asperuloside

SCHEMBL7637719

CC(=O)OCC1=C[C@@H]2OC(=O)C3=COC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C1C32.OC[C@H]1O[C@@H](Oc2ccccc2)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	PTPN1	P18031	8/20	0.38

▸	PTPN2	P17706	1/20	0.38

▸	PTPN11	Q06124	1/20	0.38

▸	SLC6A2	P23975	1/20	0.37

▸	ELANE	P08246	1/20	0.36

▸	STAT3	P40763	1/20	0.33

▸	LGALS8	O00214	1/20	0.33

▸	FGF1	P05230	1/20	0.33

▸	FGF2	P09038	1/20	0.33

▸	VEGFA	P15692	1/20	0.33

▸	HPSE	Q9Y251	1/20	0.33

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
Asperuloside SCHEMBL31666329	0.85	STAT3 (0.42)	PTPN1ELANESTAT3
Asperuloside SCHEMBL308266	0.85	STAT3 (0.42)	PTPN1ELANESTAT3
Asperuloside SCHEMBL308265	0.85	STAT3 (0.42)	PTPN1ELANESTAT3
Paederoside SCHEMBL422181	0.77	STAT3 (0.41)	PTPN1ELANESTAT3
Asperuloside SCHEMBL23495463	0.77	PTPN1 (0.38)	PTPN1ELANESTAT3
Deacetylasperuloside SCHEMBL29367563	0.75	L3MBTL1 (0.53)	PTPN1ELANESTAT3
SCHEMBL29425770	0.75	STAT3 (0.41)	ELANESTAT3
SCHEMBL29426081	0.74	L3MBTL1 (0.41)	PTPN1ELANESTAT3
SCHEMBL422234	0.70	ELANE (0.41)	PTPN1ELANESTAT3
SCHEMBL419331	0.70	ELANE (0.41)	PTPN1ELANESTAT3

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-6468688-B2	CHARGING, DISCHARGING EFFICIENCY; VANADIUM ELECTROLYTE	PINNACLE VRB LIMITED (AU)	2002-10-22	—	—	US	disclosed
US-20010028977-A1	Charging, discharging efficiency; vanadium electrolyte	JD HOLDING INC. (KY)	2001-10-11	—	—	US	disclosed