SCHEMBL30495606

CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	OPRL1	P41146	6/20	0.54

▸	CCKBR	P32239	3/20	0.51

▸	PTH1R	Q03431	1/20	0.49

▸	OPRD1	P41143	2/20	0.48

▸	CCKAR	P32238	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
SCHEMBL31598482	0.89	CCKBR (0.53)	OPRL1CCKBROPRD1CCKAR
SCHEMBL31598488	0.89	CCKBR (0.53)	OPRL1CCKBROPRD1CCKAR
SCHEMBL30432209	0.84	TFPI (0.55)	OPRL1
SCHEMBL29592709	0.84	OPRD1 (0.49)	OPRL1OPRD1
SCHEMBL31480024	0.83	OPRL1 (0.63)	OPRL1OPRD1
SCHEMBL30431350	0.82	OPRL1 (0.59)	OPRL1CCKBRPTH1R
SCHEMBL7592267	0.82	OPRD1 (0.49)	OPRL1OPRD1
SCHEMBL7592268	0.82	OPRD1 (0.49)	OPRL1OPRD1
Tyrlysseraspserphetyrglyleumet SCHEMBL30475005	0.82	OPRM1 (0.61)	CCKBROPRD1
SCHEMBL23273225	0.81	TFPI (0.54)	OPRL1CCKBRPTH1R

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-20230190887-A1	TARGETING G3BP AGGREGATION TO PREVENT NEURODEGENERATION	UNIVERSITY OF SOUTH CAROLINA (US)	2023-06-22	—	—	US	disclosed