SCHEMBL30080640

CC(C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	C5AR1	P21730	2/20	0.57

▸	IL23R	Q5VWK5	16/20	0.53

▸	CD47	Q08722	1/20	0.48

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
SCHEMBL30080698	0.96	C5AR1 (0.55)	C5AR1IL23RCD47
SCHEMBL30130535	0.92	C5AR1 (0.61)	C5AR1IL23RCD47
SCHEMBL30130567	0.92	C5AR1 (0.61)	C5AR1IL23RCD47
SCHEMBL30093087	0.92	C5AR1 (0.60)	C5AR1IL23RCD47
SCHEMBL30093071	0.90	C5AR1 (0.54)	C5AR1IL23RCD47
SCHEMBL30577977	0.90	GLP1R (0.56)	—
SCHEMBL29476582	0.89	C5AR1 (0.55)	C5AR1IL23RCD47
SCHEMBL30130533	0.89	C5AR1 (0.55)	C5AR1CD47
SCHEMBL30093002	0.89	C5AR1 (0.55)	C5AR1CD47
SCHEMBL31257022	0.89	C5AR1 (0.49)	C5AR1

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-115594737-A	Shellfish antibacterial peptide B2-alpha and application thereof	浙江海洋大学（CN）	2023-01-13	—	—	CN	disclosed