SCHEMBL30495831

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C

nearest known ligand 0.57

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	VIPR2	P41587	6/20	0.57

▸	VIPR1	P32241	4/20	0.57

▸	GLP1R	P43220	11/20	0.56

▸	GCGR	P47871	1/20	0.55

▸	GIPR	P48546	1/20	0.55

▸	CCKBR	P32239	1/20	0.54

▸	CALCR	P30988	1/20	0.54

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
SCHEMBL30974556	0.91	GLP1R (0.54)	VIPR2VIPR1GLP1R
SCHEMBL31182784	0.91	VIPR1 (0.62)	VIPR2VIPR1GLP1RGCGRGIPR
SCHEMBL29410242	0.91	GLP1R (0.64)	GLP1RCCKBRCALCR
SCHEMBL30495764	0.90	GLP1R (0.58)	VIPR2VIPR1GLP1RGCGRGIPR
SCHEMBL30176430	0.90	VIPR2 (0.57)	VIPR2VIPR1GLP1RGCGRGIPR
SCHEMBL30607297	0.89	VIPR2 (0.60)	VIPR2VIPR1GLP1RGCGRGIPR
SCHEMBL30262094	0.89	PTH1R (0.54)	VIPR1GLP1RGCGRGIPR
SCHEMBL30495588	0.89	CALCR (0.64)	VIPR2VIPR1GLP1RCCKBRCALCR
SCHEMBL31332028	0.88	VIPR2 (0.66)	VIPR2VIPR1GLP1RGCGRGIPR
SCHEMBL31190181	0.88	PTH1R (0.61)	GLP1R

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