SCHEMBL30093113

CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC

nearest known ligand 0.61

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	PCSK9	Q8NBP7	2/20	0.61

▸	RXFP1	Q9HBX9	4/20	0.59

▸	NPBWR1	P48145	7/20	0.57

▸	PTH1R	Q03431	2/20	0.54

▸	IL23R	Q5VWK5	3/20	0.53

▸	KEAP1	Q14145	1/20	0.52

▸	ECE1	P42892	1/20	0.51

▸	GLP1R	P43220	1/20	0.51

▸	MUS81	Q96NY9	1/20	0.51

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
SCHEMBL30093105	1.00	PCSK9 (0.61)	PCSK9RXFP1NPBWR1PTH1RIL23R
SCHEMBL30093054	0.97	PCSK9 (0.60)	PCSK9RXFP1NPBWR1PTH1RIL23R
SCHEMBL30093120	0.97	PCSK9 (0.60)	PCSK9RXFP1NPBWR1PTH1RIL23R
SCHEMBL30093033	0.96	PCSK9 (0.61)	PCSK9RXFP1NPBWR1PTH1RIL23R
SCHEMBL30093038	0.96	PCSK9 (0.61)	PCSK9RXFP1NPBWR1PTH1RIL23R
SCHEMBL30092946	0.96	PCSK9 (0.61)	PCSK9RXFP1NPBWR1PTH1RIL23R
SCHEMBL30092990	0.96	PCSK9 (0.61)	PCSK9RXFP1NPBWR1PTH1RIL23R
SCHEMBL30093055	0.96	PCSK9 (0.61)	PCSK9RXFP1NPBWR1PTH1RIL23R
SCHEMBL30092908	0.95	PCSK9 (0.61)	PCSK9RXFP1NPBWR1PTH1RIL23R
SCHEMBL30093024	0.95	PCSK9 (0.61)	PCSK9RXFP1NPBWR1PTH1RIL23R

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
CN-115397836-A	Novel antibacterial peptide and application thereof	安尼根有限公司	2022-11-25	—	—	CN	claimed
CN-115397836-A	Novel antibacterial peptide and application thereof	安尼根有限公司	2022-11-25	—	—	CN	disclosed