SCHEMBL31247325

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CXCL8	P10145	10/20	0.56

▸	CAPN1	P07384	2/20	0.52

▸	CTSB	P07858	2/20	0.52

▸	CTSL	P07711	3/20	0.51

▸	CTSS	P25774	3/20	0.51

▸	CTSK	P43235	3/20	0.51

▸	CTSH	P09668	1/20	0.51

▸	DPP3	Q9NY33	2/20	0.51

▸	CXCR4	P61073	2/20	0.48

▸	MEN1	O00255	1/20	0.48

▸	KMT2A	Q03164	1/20	0.48

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
SCHEMBL31247508	0.97	CXCL8 (0.55)	CXCL8CAPN1CTSBCTSLCTSS
SCHEMBL30690109	0.97	CXCL8 (0.58)	CXCL8CAPN1CTSBCTSLCTSS
SCHEMBL31247683	0.96	CAPN1 (0.56)	CXCL8CAPN1CTSBCTSLCTSS
SCHEMBL30690108	0.95	CAPN1 (0.59)	CXCL8CAPN1CTSBDPP3CXCR4
SCHEMBL30690107	0.95	CAPN1 (0.59)	CXCL8CAPN1CTSBDPP3CXCR4
SCHEMBL30690106	0.94	CXCL8 (0.52)	CXCL8CAPN1CTSBDPP3CXCR4
SCHEMBL31247348	0.93	CAPN1 (0.57)	CXCL8CAPN1CTSBCTSLCTSS
SCHEMBL31247304	0.93	CAPN1 (0.60)	CXCL8CAPN1CTSBCTSLCTSS
SCHEMBL30690087	0.93	CAPN1 (0.57)	CXCL8CAPN1CTSBDPP3CXCR4
SCHEMBL31247502	0.92	CXCL8 (0.54)	CXCL8CAPN1CTSBCTSLCTSS

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
WO-2024235070-A1	PEPTIDE COMPOUND, COMPOSITION AND USE THEREOF	杭州禾泰健宇生物科技有限公司	2024-11-21	—	—	WO	disclosed