SCHEMBL30032896

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

nearest known ligand 0.62

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	C5AR1	P21730	1/20	0.61

▸	CALCR	P30988	5/20	0.60

▸	NPY2R	P49146	7/20	0.60

▸	NPY4R	P50391	7/20	0.60

▸	NPY5R	Q15761	7/20	0.60

▸	NPY1R	P25929	5/20	0.60

▸	GLP1R	P43220	3/20	0.59

▸	GCGR	P47871	3/20	0.59

▸	RAMP1	O60894	1/20	0.57

▸	RAMP2	O60895	1/20	0.57

▸	RAMP3	O60896	1/20	0.57

▸	CALCRL	Q16602	1/20	0.57

▸	MC4R	P32245	1/20	0.56

▸	TFPI	P10646	1/20	0.56

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
SCHEMBL30034800	0.98	CALCR (0.61)	C5AR1CALCRNPY2RNPY4RNPY5R
SCHEMBL30033607	0.96	CALCR (0.63)	C5AR1CALCRNPY2RNPY4RNPY5R
SCHEMBL30033676	0.96	CALCR (0.63)	C5AR1CALCRNPY2RNPY4RNPY5R
SCHEMBL30034444	0.95	CALCR (0.66)	C5AR1CALCRNPY2RNPY4RNPY5R
SCHEMBL30034542	0.95	CALCR (0.61)	C5AR1CALCRNPY2RNPY4RNPY5R
SCHEMBL29638059	0.91	MC4R (0.61)	C5AR1CALCRNPY2RNPY4RNPY5R
SCHEMBL29638066	0.91	MC4R (0.61)	C5AR1CALCRNPY2RNPY4RNPY5R
SCHEMBL29593115	0.88	C5AR1 (0.69)	C5AR1NPY2RNPY4RNPY5RNPY1R
SCHEMBL29593954	0.88	C5AR1 (0.69)	C5AR1NPY2RNPY4RNPY5RNPY1R
SCHEMBL29593655	0.88	C5AR1 (0.69)	C5AR1NPY2RNPY4RNPY5RNPY1R

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-111239302-B	Method for obtaining specific peptide fragments by utilizing endoprotease to cut collagen and application	南京中医药大学	2022-08-26	—	—	CN	disclosed