SCHEMBL31247473

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

nearest known ligand 0.55

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	CAPN1	P07384	2/20	0.55

▸	CTSB	P07858	2/20	0.55

▸	CXCL8	P10145	10/20	0.52

▸	GLP1R	P43220	8/20	0.51

▸	GIPR	P48546	7/20	0.49

▸	GCGR	P47871	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
SCHEMBL31247554	0.97	CAPN1 (0.54)	CAPN1CTSBCXCL8GLP1RGIPR
SCHEMBL30690108	0.94	CAPN1 (0.59)	CAPN1CTSBCXCL8
SCHEMBL30690107	0.94	CAPN1 (0.59)	CAPN1CTSBCXCL8
SCHEMBL31247583	0.94	CAPN1 (0.57)	CAPN1CTSBCXCL8GLP1RGIPR
SCHEMBL30690087	0.92	CAPN1 (0.57)	CAPN1CTSBCXCL8
SCHEMBL30690109	0.91	CXCL8 (0.58)	CAPN1CTSBCXCL8
SCHEMBL30690070	0.91	CAPN1 (0.57)	CAPN1CTSBCXCL8
SCHEMBL31247508	0.90	CXCL8 (0.55)	CAPN1CTSBCXCL8
SCHEMBL31247320	0.90	CAPN1 (0.53)	CAPN1CTSBCXCL8GLP1RGIPR
SCHEMBL31247492	0.90	CAPN1 (0.63)	CAPN1CTSBCXCL8

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