SCHEMBL31475686

CC(C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)NCC(N)=O

nearest known ligand 0.59

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CTSL	P07711	3/20	0.59

▸	CTSS	P25774	3/20	0.59

▸	CTSK	P43235	3/20	0.59

▸	CTSH	P09668	1/20	0.59

▸	GRPR	P30550	5/20	0.59

▸	NMBR	P28336	2/20	0.59

▸	C5AR1	P21730	2/20	0.51

▸	GLP1R	P43220	5/20	0.50

▸	CCKBR	P32239	2/20	0.50

▸	KISS1R	Q969F8	1/20	0.50

▸	GCGR	P47871	3/20	0.49

▸	KEAP1	Q14145	1/20	0.49

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
SCHEMBL30460317	0.99	CTSL (0.59)	CTSLCTSSCTSKCTSHGRPR
SCHEMBL31475697	0.96	NMBR (0.60)	CTSLCTSSCTSKCTSHGRPR
SCHEMBL31475687	0.94	CTSL (0.66)	CTSLCTSSCTSKCTSHGRPR
SCHEMBL31475675	0.92	CTSL (0.60)	CTSLCTSSCTSKCTSHGRPR
SCHEMBL29945131	0.91	NMBR (0.62)	CTSLCTSSCTSKCTSHGRPR
SCHEMBL31725226	0.90	NMBR (0.60)	CTSLCTSSCTSKCTSHGRPR
SCHEMBL31475698	0.90	GRPR (0.52)	CTSLCTSSCTSKCTSHGRPR
SCHEMBL31475683	0.85	CXCR4 (0.55)	CTSLCTSSCTSKCTSHGRPR
SCHEMBL31656504	0.85	C5AR1 (0.65)	GRPRNMBRC5AR1GLP1RCCKBR
SCHEMBL30432200	0.85	NMBR (0.58)	CTSLCTSSCTSKCTSHGRPR

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
US-20250129126-A1	LONG-LASTING HEPATITIS VIRUS ENTRY INHIBITOR	Chengdu AODA Biotechnology Co., Ltd (CN)	2025-04-24	—	—	US	disclosed