SCHEMBL30466128

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	3/20	0.70

▸	GLP1R	P43220	13/20	0.68

▸	GCGR	P47871	8/20	0.68

▸	GIPR	P48546	5/20	0.68

▸	KEAP1	Q14145	1/20	0.66

▸	NPY1R	P25929	1/20	0.66

▸	NPY2R	P49146	1/20	0.66

▸	NPY4R	P50391	1/20	0.66

▸	NPY5R	Q15761	1/20	0.66

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
SCHEMBL30466130	0.98	GLP1R (0.69)	CALCRGLP1RGCGRGIPRKEAP1
SCHEMBL30466127	0.94	GLP1R (0.69)	CALCRGLP1RGCGRGIPRKEAP1
SCHEMBL30159330	0.93	CALCR (0.73)	CALCRGLP1RGCGRGIPRKEAP1
SCHEMBL30422908	0.93	GLP1R (0.73)	CALCRGLP1RGCGRGIPRKEAP1
SCHEMBL30423071	0.93	GLP1R (0.73)	CALCRGLP1RGCGRGIPRKEAP1
SCHEMBL30423442	0.93	GLP1R (0.73)	CALCRGLP1RGCGRGIPRKEAP1
SCHEMBL31182991	0.93	CALCR (0.69)	CALCRGLP1RGCGRGIPRKEAP1
SCHEMBL30422794	0.93	GLP1R (0.74)	CALCRGLP1RGCGRGIPRKEAP1
SCHEMBL31139990	0.93	GLP1R (0.77)	CALCRGLP1RGCGRGIPR
SCHEMBL31148823	0.93	GLP1R (0.69)	CALCRGLP1RGCGRGIPRKEAP1

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-116217693-B	Conus toxin exosome and application thereof	广东扶生肽生物科技有限公司	2023-11-03	—	—	CN	claimed
CN-116217693-A	Conus toxin exosome and application thereof	广东扶生肽生物科技有限公司	2023-06-06	—	—	CN	claimed