SCHEMBL30596084

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	5/20	0.64

▸	KISS1R	Q969F8	13/20	0.64

▸	OPRM1	P35372	1/20	0.59

▸	OPRD1	P41143	1/20	0.59

▸	ECE1	P42892	1/20	0.58

▸	GLP1R	P43220	1/20	0.58

▸	MUS81	Q96NY9	1/20	0.58

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
SCHEMBL30596173	0.99	IL23R (0.65)	IL23RKISS1R
SCHEMBL30471720	0.93	OPRM1 (0.65)	IL23RKISS1ROPRM1OPRD1
SCHEMBL30596141	0.93	IL23R (0.69)	IL23RKISS1RECE1GLP1RMUS81
SCHEMBL31688309	0.89	IL23R (0.64)	IL23RKISS1RECE1GLP1RMUS81
SCHEMBL30578727	0.89	IL23R (0.62)	IL23RKISS1ROPRM1OPRD1
SCHEMBL29610039	0.88	GLP1R (0.66)	IL23RKISS1RECE1GLP1RMUS81
SCHEMBL30382016	0.88	PRMT1 (0.57)	IL23RKISS1ROPRM1OPRD1ECE1
SCHEMBL38650746	0.88	GLP1R (0.65)	IL23RKISS1RECE1GLP1RMUS81
SCHEMBL31442261	0.87	OPRD1 (0.71)	IL23RKISS1ROPRM1OPRD1
SCHEMBL31462103	0.87	GLP1R (0.58)	IL23RKISS1RECE1GLP1RMUS81

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-116804045-A	Polypeptide targeting HPV16E6 protein and preparation method and application thereof	东南大学	2023-09-26	—	—	CN	disclosed