SCHEMBL29722992

CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O

nearest known ligand 0.66

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	12/20	0.66

▸	CCKBR	P32239	6/20	0.64

▸	CCKAR	P32238	1/20	0.62

▸	OPRD1	P41143	1/20	0.62

▸	GLP1R	P43220	2/20	0.60

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
SCHEMBL30712980	0.91	GLP1R (0.69)	IL23RCCKBRCCKAROPRD1GLP1R
SCHEMBL30712897	0.90	IL23R (0.59)	IL23RCCKBRCCKAROPRD1GLP1R
SCHEMBL29484168	0.88	IL23R (0.70)	IL23RCCKBR
SCHEMBL3647056	0.88	IL23R (0.70)	IL23RCCKBR
SCHEMBL3642270	0.88	IL23R (0.70)	IL23RCCKBR
SCHEMBL35210884	0.87	GLP1R (0.64)	IL23RCCKBRGLP1R
SCHEMBL30712948	0.86	GLP1R (0.66)	IL23RCCKBRGLP1R
SCHEMBL30512602	0.86	IL23R (0.59)	IL23RCCKBRCCKAROPRD1GLP1R
SCHEMBL29418257	0.86	BACE1 (0.62)	IL23RCCKBRCCKAROPRD1GLP1R
SCHEMBL29363662	0.86	KISS1R (0.67)	IL23R

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-114773468-B	Polypeptide specifically combined with PD-L1 and application thereof	江苏大学	2023-10-10	—	—	CN	disclosed
CN-114773468-A	Polypeptide specifically bound with PD-L1 and application thereof	江苏大学	2022-07-22	—	—	CN	disclosed