SCHEMBL30607741

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

nearest known ligand 0.62

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	12/20	0.62

▸	KISS1R	Q969F8	4/20	0.59

▸	NPBWR1	P48145	3/20	0.57

▸	ECE1	P42892	1/20	0.56

▸	GLP1R	P43220	1/20	0.56

▸	MUS81	Q96NY9	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
SCHEMBL30523600	1.00	IL23R (0.62)	IL23RKISS1RNPBWR1ECE1GLP1R
SCHEMBL30607750	0.94	KISS1R (0.61)	IL23RKISS1RNPBWR1ECE1GLP1R
SCHEMBL30607740	0.94	KISS1R (0.61)	IL23RKISS1RNPBWR1ECE1GLP1R
SCHEMBL30607735	0.94	KISS1R (0.61)	IL23RKISS1RNPBWR1ECE1GLP1R
SCHEMBL30607747	0.94	KISS1R (0.61)	IL23RKISS1RNPBWR1ECE1GLP1R
SCHEMBL30607744	0.94	KISS1R (0.61)	IL23RKISS1RNPBWR1ECE1GLP1R
SCHEMBL30130543	0.94	KISS1R (0.62)	IL23RKISS1RNPBWR1ECE1GLP1R
SCHEMBL30571041	0.94	KISS1R (0.62)	IL23RKISS1RNPBWR1ECE1GLP1R
SCHEMBL30130560	0.94	KISS1R (0.62)	IL23RKISS1RNPBWR1ECE1GLP1R
SCHEMBL30130579	0.94	KISS1R (0.62)	IL23RKISS1RNPBWR1ECE1GLP1R

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-116535466-A	Polypeptide and preparation method and application thereof	山东省农业科学院	2023-08-04	—	—	CN	disclosed