SCHEMBL31312605

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)NC(=O)[C@@H](NC(=O)[C@H](COC(C)(C)C)NC(=O)[C@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)[C@H](COC(C)(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)C(C)(C)NC(=O)[C@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C)[C@@H](C)OC(C)(C)C)[C@@H](C)CC)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	PSEN1	P49768	16/20	0.47

▸	PSEN2	P49810	16/20	0.47

▸	APH1B	Q8WW43	16/20	0.47

▸	NCSTN	Q92542	16/20	0.47

▸	APH1A	Q96BI3	16/20	0.47

▸	PSENEN	Q9NZ42	16/20	0.47

▸	OPRM1	P35372	4/20	0.43

▸	OPRD1	P41143	4/20	0.43

▸	OPRK1	P41145	4/20	0.43

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
SCHEMBL31114335	0.98	PSEN1 (0.47)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30892073	0.98	PSEN1 (0.47)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL31518747	0.94	PSEN1 (0.47)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL31518743	0.94	PSEN1 (0.47)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL38652065	0.93	PSEN1 (0.43)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30543492	0.93	GLP1R (0.46)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30543486	0.92	OPRM1 (0.46)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL38651875	0.91	OPRM1 (0.46)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL38651798	0.91	OPRM1 (0.46)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29616427	0.91	PSEN1 (0.47)	PSEN1PSEN2APH1BNCSTNAPH1A

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-119241683-A	Tenipout peptide synthesis method	深圳翰宇药业股份有限公司	2025-01-03	—	—	CN	disclosed