SCHEMBL31303098

CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	NMUR2	Q9GZQ4	5/20	0.62

▸	NMUR1	Q9HB89	5/20	0.62

▸	RAMP3	O60896	1/20	0.56

▸	CALCR	P30988	1/20	0.56

▸	APLNR	P35414	1/20	0.56

▸	GLP1R	P43220	3/20	0.53

▸	GCGR	P47871	3/20	0.53

▸	CXCR4	P61073	2/20	0.53

▸	OPRM1	P35372	1/20	0.53

▸	OPRD1	P41143	1/20	0.53

▸	NPY1R	P25929	1/20	0.53

▸	NPY2R	P49146	1/20	0.53

▸	NPY4R	P50391	1/20	0.53

▸	NPY5R	Q15761	1/20	0.53

▸	TFPI	P10646	1/20	0.52

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
Catestatin SCHEMBL29498741	0.92	NMUR2 (0.58)	NMUR2NMUR1RAMP3CALCRAPLNR
SCHEMBL30495655	0.87	NMUR2 (0.64)	NMUR2NMUR1RAMP3CALCRCXCR4
SCHEMBL30974393	0.85	NMUR2 (0.61)	NMUR2NMUR1CALCRNPY1RNPY2R
SCHEMBL31154636	0.84	NMUR2 (0.61)	NMUR2NMUR1RAMP3CALCROPRM1
SCHEMBL30524359	0.84	TFPI (0.61)	GLP1RGCGRNPY1RNPY4RNPY5R
SCHEMBL30842169	0.84	NMUR2 (0.65)	NMUR2NMUR1APLNROPRM1OPRD1
SCHEMBL30433007	0.84	CALCR (0.65)	NMUR2NMUR1RAMP3CALCRNPY1R
SCHEMBL30495803	0.84	NMUR2 (0.52)	NMUR2NMUR1APLNRGLP1RGCGR
SCHEMBL31105502	0.84	NMUR2 (0.72)	NMUR2NMUR1RAMP3CALCRCXCR4
SCHEMBL31121841	0.84	NMUR2 (0.68)	NMUR2NMUR1RAMP3CALCRCXCR4

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-119214189-A	Child-prepared milk powder and preparation method and application thereof	逸盈养健康科技(沈阳)有限公司	2024-12-31	—	—	CN	disclosed