SCHEMBL31436710

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	14/20	0.59

▸	PTH1R	Q03431	1/20	0.56

▸	CALCR	P30988	4/20	0.56

▸	SCTR	P47872	1/20	0.56

▸	VIPR2	P41587	1/20	0.56

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
SCHEMBL31514317	0.95	GLP1R (0.55)	GLP1RPTH1RCALCRSCTRVIPR2
SCHEMBL30168729	0.95	GLP1R (0.56)	GLP1RPTH1RSCTRVIPR2
SCHEMBL30168744	0.95	GLP1R (0.56)	GLP1RPTH1RSCTRVIPR2
SCHEMBL29836359	0.92	GLP1R (0.56)	GLP1RPTH1RCALCRSCTRVIPR2
SCHEMBL29836307	0.92	GLP1R (0.56)	GLP1RPTH1RCALCRSCTRVIPR2
SCHEMBL30168773	0.92	GLP1R (0.58)	GLP1RPTH1RSCTRVIPR2
SCHEMBL30168724	0.91	GLP1R (0.57)	GLP1RPTH1RSCTRVIPR2
SCHEMBL30168741	0.90	GLP1R (0.61)	GLP1RPTH1RSCTR
SCHEMBL30168685	0.90	GLP1R (0.61)	GLP1RPTH1RSCTR
SCHEMBL30168768	0.90	GLP1R (0.61)	GLP1RPTH1RSCTR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-119564617-A	Traditional Chinese medicine nanoparticle with tumor targeting function and preparation method thereof	黑龙江中医药大学	2025-03-07	—	—	CN	claimed
CN-119564617-A	Traditional Chinese medicine nanoparticle with tumor targeting function and preparation method thereof	黑龙江中医药大学	2025-03-07	—	—	CN	disclosed