SCHEMBL29982420

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(C)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	3/20	0.58

▸	KISS1R	Q969F8	5/20	0.57

▸	NPY1R	P25929	1/20	0.56

▸	NPY2R	P49146	1/20	0.56

▸	NPY4R	P50391	1/20	0.56

▸	NPY5R	Q15761	1/20	0.56

▸	C5AR1	P21730	1/20	0.55

▸	EPHA2	P29317	2/20	0.54

▸	AGTR1	P30556	1/20	0.54

▸	AGTR2	P50052	1/20	0.54

▸	CXCR4	P61073	3/20	0.53

▸	PRLHR	P49683	2/20	0.53

▸	MAPK8	P45983	1/20	0.53

▸	MAPK9	P45984	1/20	0.53

▸	MAPK10	P53779	1/20	0.53

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
SCHEMBL30092475	1.00	IL23R (0.58)	IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL30432026	0.90	NPY2R (0.66)	IL23RNPY1RNPY2RNPY4RNPY5R
SCHEMBL31488939	0.89	KISS1R (0.63)	IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL31182600	0.87	NPY2R (0.67)	IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL30607471	0.87	NPY2R (0.68)	IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL31489038	0.86	KISS1R (0.60)	IL23RKISS1RNPY1RNPY2RNPY4R
SCHEMBL31620052	0.86	C5AR1 (0.57)	IL23RKISS1RC5AR1EPHA2CXCR4
SCHEMBL29982283	0.86	KISS1R (0.62)	IL23RKISS1R
SCHEMBL30401709	0.86	KISS1R (0.62)	IL23RKISS1R
SCHEMBL30401759	0.86	KISS1R (0.61)	IL23RKISS1R

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-115151556-A	Human transferrin receptor binding peptides	JCR制药股份有限公司	2022-10-04	—	—	CN	claimed
CN-115151556-A	Human transferrin receptor binding peptides	JCR制药股份有限公司	2022-10-04	—	—	CN	disclosed