SCHEMBL31291033

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O

nearest known ligand 0.60

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	NPY1R	P25929	3/20	0.60

▸	OPRD1	P41143	5/20	0.59

▸	OPRM1	P35372	7/20	0.59

▸	OPRK1	P41145	7/20	0.59

▸	NPY2R	P49146	1/20	0.58

▸	NPY4R	P50391	1/20	0.58

▸	NPY5R	Q15761	1/20	0.58

▸	NTSR2	O95665	2/20	0.57

▸	NTSR1	P30989	2/20	0.57

▸	SORT1	Q99523	2/20	0.57

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
SCHEMBL29708093	0.94	OPRM1 (0.65)	OPRD1OPRM1OPRK1
SCHEMBL30498028	0.94	OPRM1 (0.65)	OPRD1OPRM1OPRK1
SCHEMBL30956237	0.90	NPY1R (0.70)	NPY1ROPRD1OPRM1OPRK1NPY2R
SCHEMBL30498025	0.89	OPRM1 (0.53)	NPY1ROPRD1OPRM1OPRK1
SCHEMBL30498026	0.88	OPRM1 (0.60)	OPRD1OPRM1OPRK1
SCHEMBL31519873	0.88	OPRD1 (0.62)	NPY1ROPRD1NPY2RNPY4RNPY5R
SCHEMBL29675119	0.87	CXCR4 (0.59)	OPRM1OPRK1
SCHEMBL29674929	0.87	CXCR4 (0.59)	OPRM1OPRK1
SCHEMBL13402670	0.87	OPRM1 (0.62)	NPY1ROPRM1OPRK1NPY2RNPY4R
SCHEMBL31738532	0.86	NTSR1 (0.76)	NTSR2NTSR1SORT1

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-115003815-B	Wheat transgenic event IND-2, 412-7	百塞生技有限责任公司	2024-12-13	—	—	CN	disclosed