SCHEMBL31575688

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(C)C)[C@@H](C)O

nearest known ligand 0.69

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.62

▸	NPY2R	P49146	8/20	0.61

▸	NPY4R	P50391	8/20	0.61

▸	NPY5R	Q15761	8/20	0.61

▸	NPY1R	P25929	6/20	0.61

▸	OPRD1	P41143	3/20	0.60

▸	CRHR1	P34998	1/20	0.58

▸	CRHR2	Q13324	1/20	0.58

▸	OPRM1	P35372	1/20	0.58

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
SCHEMBL29558249	0.90	OPRD1 (0.59)	CALCRNPY2RNPY4RNPY5ROPRD1
SCHEMBL30974025	0.89	OPRM1 (0.58)	OPRD1OPRM1
SCHEMBL11667495	0.89	CALCR (0.70)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31575686	0.89	OPRD1 (0.59)	OPRD1OPRM1
SCHEMBL11660133	0.89	CALCR (0.73)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31182450	0.89	NPY2R (0.66)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL11660011	0.88	CALCR (0.72)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31232439	0.88	OPRM1 (0.63)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL11667572	0.88	CALCR (0.71)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30304511	0.88	CALCR (0.69)	CALCRNPY2RNPY4RNPY5RNPY1R

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-120019812-A	Artificial toad venom composition and application thereof	南京中医药大学	2025-05-20	—	—	CN	claimed
CN-120019812-A	Artificial toad venom composition and application thereof	南京中医药大学	2025-05-20	—	—	CN	disclosed