SCHEMBL30887922

C[C@H](CC[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(C)(C)O)[C@H]1[C@@H](O)C[C@@]2(C)[C@@H]3C[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O[C@@H]5OC[C@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]12C

nearest known ligand 0.65

Predicted protein targets (top 18)

	gene	UniProt	supporting neighbours	confidence
▸	TYR	P14679	4/20	0.65

▸	PSEN1	P49768	5/20	0.40

▸	PSEN2	P49810	5/20	0.40

▸	APH1B	Q8WW43	5/20	0.40

▸	NCSTN	Q92542	5/20	0.40

▸	APH1A	Q96BI3	5/20	0.40

▸	PSENEN	Q9NZ42	5/20	0.40

▸	PRKAG1	P54619	3/20	0.38

▸	PRKAA2	P54646	3/20	0.38

▸	PRKAB1	Q9Y478	3/20	0.38

▸	EPHX2	P34913	3/20	0.37

▸	SLCO1B3	Q9NPD5	1/20	0.36

▸	SLCO1B1	Q9Y6L6	1/20	0.36

▸	CRHBP	P24387	2/20	0.35

▸	CRHR2	Q13324	2/20	0.35

▸	GLS	O94925	1/20	0.35

▸	MAPK1	P28482	1/20	0.34

▸	NPSR1	Q6W5P4	1/20	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
SCHEMBL30887919	0.97	TYR (0.69)	TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30887923	0.97	TYR (0.61)	TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30887924	0.93	TYR (0.62)	TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30678767	0.93	TYR (0.66)	TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30887925	0.93	TYR (0.55)	TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30678803	0.92	TYR (0.65)	TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30190169	0.90	TYR (0.70)	TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30887921	0.89	TYR (0.66)	TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30678758	0.89	TYR (0.61)	TYRPSEN1PSEN2APH1BNCSTN
SCHEMBL30190326	0.88	TYR (0.59)	TYRPSEN1PSEN2APH1BNCSTN

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
CN-117599123-A	Compositions, methods and pharmaceutical compositions for treating and maintaining liver health	尤尼根公司	2024-02-27	—	—	CN	disclosed