SCHEMBL29973033

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	NPY4R	P50391	12/20	0.50

▸	NPY1R	P25929	7/20	0.50

▸	NPY2R	P49146	5/20	0.50

▸	NPY5R	Q15761	5/20	0.50

▸	MAPK8	P45983	1/20	0.42

▸	MAPK9	P45984	1/20	0.42

▸	MAPK10	P53779	1/20	0.42

▸	MDM4	O15151	1/20	0.41

▸	MDM2	Q00987	1/20	0.41

▸	KISS1R	Q969F8	2/20	0.40

▸	CTSB	P07858	1/20	0.40

▸	CTSK	P43235	1/20	0.40

▸	ENPEP	Q07075	2/20	0.40

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
SCHEMBL30812335	0.97	NPY4R (0.50)	NPY4RNPY1RNPY2RNPY5RMAPK8
SCHEMBL30353300	0.95	NPY4R (0.44)	NPY4RNPY1RNPY2RNPY5RMAPK8
SCHEMBL29379956	0.90	NPY4R (0.52)	NPY4RNPY1RNPY2RNPY5R
SCHEMBL29770304	0.89	NPY4R (0.51)	NPY4RNPY1RNPY2RNPY5R
SCHEMBL30812336	0.89	NPY4R (0.46)	NPY4RNPY1RNPY2RNPY5R
SCHEMBL30093085	0.89	NPY4R (0.45)	NPY4RNPY1RNPY2RNPY5RCTSB
SCHEMBL31084112	0.88	NPY4R (0.47)	NPY4RNPY1RNPY2RNPY5R
SCHEMBL30148464	0.88	NPY4R (0.48)	NPY4RNPY1RNPY2RNPY5RENPEP
SCHEMBL30456308	0.88	NPY4R (0.48)	NPY4RNPY1RNPY2RNPY5RENPEP
SCHEMBL30456269	0.88	NPY4R (0.48)	NPY4RNPY1RNPY2RNPY5RENPEP

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
EP-4067370-A1	HIGH PENETRATION PRODRUG COMPOSITIONS OF PEPTIDES AND PEPTIDE RELATED COMPOUNDS	Yu, Chongxi (US)	2022-10-05	—	—	EP	disclosed