SCHEMBL31522801

CC[C@](C)(NC(=O)[C@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](CC(=O)OC(C)(C)C)C(=O)O)[C@@H](C)OC(C)(C)C)[C@@H](C)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	ABCB1	P08183	1/20	0.39

▸	CCKBR	P32239	11/20	0.38

▸	CCKAR	P32238	7/20	0.38

▸	REN	P00797	4/20	0.37

▸	PSMB1	P20618	2/20	0.37

▸	PSMB8	P28062	2/20	0.37

▸	PSMB9	P28065	2/20	0.37

▸	PSMB5	P28074	2/20	0.37

▸	PSMB10	P40306	2/20	0.37

▸	PSMB2	P49721	2/20	0.37

▸	AMY2A	P04746	4/20	0.36

▸	CTSD	P07339	1/20	0.36

▸	OPRD1	P41143	4/20	0.36

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
SCHEMBL31522796	0.97	PSMB1 (0.38)	ABCB1CCKBRCCKARRENPSMB1
SCHEMBL31522797	0.95	CTSD (0.40)	ABCB1CCKBRCCKARRENCTSD
SCHEMBL31247969	0.94	ABCB1 (0.40)	ABCB1CCKBRCCKARRENPSMB1
SCHEMBL31247966	0.92	OPRM1 (0.40)	ABCB1CCKBRCCKARRENPSMB1
SCHEMBL31247960	0.92	OPRD1 (0.40)	ABCB1CCKBRCCKARRENPSMB1
SCHEMBL31296842	0.91	CCKBR (0.41)	ABCB1CCKBRCCKARAMY2AOPRD1
SCHEMBL31247896	0.90	PSEN1 (0.40)	ABCB1CCKBRCCKARRENPSMB1
SCHEMBL38652065	0.90	PSEN1 (0.43)	ABCB1CCKBRCCKARRENCTSD
SCHEMBL31518743	0.88	PSEN1 (0.47)	RENCTSD
SCHEMBL31518747	0.88	PSEN1 (0.47)	RENCTSD

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-117756913-B	Novel long-acting polypeptide compound, composition and application thereof	内蒙古博睿精创科技有限公司	2025-05-09	—	—	CN	disclosed