SCHEMBL30977971

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	NPBWR1	P48145	3/20	0.59

▸	KISS1R	Q969F8	2/20	0.59

▸	EDNRA	P25101	1/20	0.57

▸	GHSR	Q92847	8/20	0.56

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
SCHEMBL30977972	0.98	NPBWR1 (0.61)	NPBWR1KISS1REDNRAGHSR
SCHEMBL31683722	0.98	NPBWR1 (0.61)	NPBWR1KISS1REDNRAGHSR
SCHEMBL29555177	0.96	NPBWR1 (0.64)	NPBWR1KISS1R
SCHEMBL29706172	0.96	NPBWR1 (0.56)	NPBWR1KISS1REDNRAGHSR
SCHEMBL31033142	0.95	GHSR (0.58)	NPBWR1EDNRAGHSR
SCHEMBL31033140	0.95	GHSR (0.58)	NPBWR1KISS1REDNRAGHSR
SCHEMBL29713412	0.95	GHSR (0.58)	NPBWR1EDNRAGHSR
SCHEMBL29555242	0.94	KISS1R (0.64)	NPBWR1KISS1R
SCHEMBL29555146	0.94	NPBWR1 (0.66)	NPBWR1KISS1R
SCHEMBL30093076	0.93	EDNRA (0.58)	NPBWR1KISS1REDNRAGHSR

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-118373882-A	Pseudomonas aeruginosa resisting polypeptide, antibacterial polypeptide solution and application	河南科技大学	2024-07-23	—	—	CN	disclosed
CN-118373882-A	Pseudomonas aeruginosa resisting polypeptide, antibacterial polypeptide solution and application	河南科技大学	2024-07-23	—	—	CN	disclosed