SCHEMBL30116698

CSCC[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)[C@H](NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](C)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](N)CC(C)C)[C@H](C)O)C(C)C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CALCRL	Q16602	6/20	0.59

▸	SLC6A2	P23975	1/20	0.56

▸	REN	P00797	2/20	0.52

▸	RAMP1	O60894	1/20	0.52

▸	AGTR2	P50052	3/20	0.50

▸	AGTR1	P30556	2/20	0.50

▸	CRHR1	P34998	1/20	0.49

▸	CRHR2	Q13324	1/20	0.49

▸	CXCL8	P10145	4/20	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
SCHEMBL30403578	0.93	CALCRL (0.54)	CALCRLSLC6A2RENCRHR1CRHR2
SCHEMBL38665591	0.86	SLC6A2 (0.59)	CALCRLSLC6A2CXCL8
SCHEMBL29994173	0.86	CALCRL (0.59)	CALCRLSLC6A2RENRAMP1AGTR2
SCHEMBL30123059	0.85	CALCRL (0.61)	CALCRLSLC6A2RAMP1AGTR2AGTR1
SCHEMBL38660514	0.83	RAMP3 (0.58)	CXCL8
Reltecimod SCHEMBL29430066	0.83	CXCL8 (0.53)	CALCRLRENCXCL8
SCHEMBL13130786	0.82	EPHA2 (0.59)	CALCRLSLC6A2CXCL8
SCHEMBL29516548	0.81	NTSR1 (0.57)	SLC6A2
SCHEMBL29993925	0.81	CALCRL (0.62)	CALCRLSLC6A2RAMP1
SCHEMBL29699958	0.81	SLC6A2 (0.59)	CALCRLSLC6A2

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
EP-4096697-A1	PEPTIDES USEFUL IN PRESERVATION AND/OR RESTORATION OF FUNCTIONAL PANCREATIC ISLETS AND IN TREATING DIABETES	The National Institute for Biotechnology in the Negev Ltd. (IL)	2022-12-07	—	—	EP	disclosed