SCHEMBL29965312

CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.68

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	NPY1R	P25929	1/20	0.68

▸	NPY2R	P49146	1/20	0.68

▸	NPY4R	P50391	1/20	0.68

▸	NPY5R	Q15761	1/20	0.68

▸	C5AR1	P21730	2/20	0.67

▸	GLP1R	P43220	14/20	0.65

▸	GCGR	P47871	3/20	0.65

▸	CCKBR	P32239	2/20	0.64

▸	EED	O75530	1/20	0.62

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
SCHEMBL31182590	0.93	GLP1R (0.68)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL30403572	0.93	GLP1R (0.73)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL29429574	0.92	GLP1R (0.69)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL29637829	0.92	C5AR1 (0.68)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL30712930	0.92	C5AR1 (0.63)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL31182592	0.92	C5AR1 (0.68)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL30801072	0.92	GLP1R (0.71)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL29625335	0.91	NPY1R (0.69)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL29429581	0.91	NPY1R (0.74)	NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL29429583	0.91	NPY1R (0.74)	NPY1RNPY2RNPY4RNPY5RC5AR1

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-115109121-A	Polypeptide specifically bound to RIPK3 and application thereof	北京伟峰益民科技有限公司	2022-09-27	—	—	CN	disclosed