SCHEMBL31243561

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC

nearest known ligand 0.67

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	KEAP1	Q14145	1/20	0.67

▸	GHSR	Q92847	4/20	0.64

▸	NPY2R	P49146	3/20	0.64

▸	PTH1R	Q03431	2/20	0.63

▸	VIPR2	P41587	5/20	0.62

▸	VIPR1	P32241	3/20	0.62

▸	GLP1R	P43220	4/20	0.60

▸	ECE1	P42892	1/20	0.60

▸	MUS81	Q96NY9	1/20	0.60

▸	KISS1R	Q969F8	3/20	0.60

▸	GCGR	P47871	1/20	0.60

▸	GIPR	P48546	1/20	0.60

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
SCHEMBL29770921	0.96	VIPR2 (0.65)	KEAP1GHSRNPY2RPTH1RVIPR2
SCHEMBL29880080	0.94	PTH1R (0.64)	KEAP1GHSRNPY2RPTH1RVIPR2
SCHEMBL30860112	0.94	GLP1R (0.61)	KEAP1GHSRNPY2RVIPR2VIPR1
SCHEMBL30498854	0.93	GLP1R (0.64)	KEAP1PTH1RVIPR2VIPR1GLP1R
SCHEMBL9795487	0.93	PTH1R (0.69)	KEAP1PTH1RGLP1RECE1MUS81
SCHEMBL31065739	0.92	GLP1R (0.61)	KEAP1PTH1RVIPR2VIPR1GLP1R
SCHEMBL31009219	0.92	GLP1R (0.61)	KEAP1PTH1RVIPR2VIPR1GLP1R
SCHEMBL31694505	0.92	GLP1R (0.71)	KEAP1PTH1RGLP1RECE1MUS81
SCHEMBL31622726	0.91	GLP1R (0.62)	KEAP1PTH1RVIPR2VIPR1GLP1R
SCHEMBL30763291	0.91	GLP1R (0.62)	KEAP1PTH1RVIPR2VIPR1GLP1R

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
CN-119061075-A	Cell for measuring biological activity of GLP-2 analogue drug	中国食品药品检定研究院(国家药品监督管理局医疗器械标准管理中心、中国药品检验总所)	2024-12-03	—	—	CN	claimed