SCHEMBL29625335

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)[C@@H](C)O)C(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	NPY1R	P25929	1/20	0.69

▸	NPY2R	P49146	1/20	0.69

▸	NPY4R	P50391	1/20	0.69

▸	NPY5R	Q15761	1/20	0.69

▸	GLP1R	P43220	12/20	0.67

▸	GCGR	P47871	3/20	0.67

▸	C5AR1	P21730	1/20	0.67

▸	CALCR	P30988	3/20	0.65

▸	CCKBR	P32239	2/20	0.64

▸	KEAP1	Q14145	1/20	0.64

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
SCHEMBL30658220	0.95	GLP1R (0.72)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL31182592	0.94	C5AR1 (0.68)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL31182679	0.93	GLP1R (0.72)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30403572	0.93	GLP1R (0.73)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30607337	0.92	NPY1R (0.66)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30932068	0.92	NPY1R (0.72)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL31182708	0.92	NPY1R (0.71)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL31402801	0.92	C5AR1 (0.71)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL31182875	0.92	NPY1R (0.69)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL29965312	0.91	NPY1R (0.68)	NPY1RNPY2RNPY4RNPY5RGLP1R

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-114344451-B	Application of Reg4 antibacterial peptide in treatment of pseudomonas aeruginosa infectious pneumonia	上海市肺科医院	2023-09-26	—	—	CN	disclosed
CN-114409758-A	Application of Reg4 antibacterial peptide in treatment of pathogenic escherichia coli infection	上海市儿科医学研究所	2022-04-29	—	—	CN	disclosed