SCHEMBL31243560

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.59

▸	CRHR1	P34998	1/20	0.58

▸	CRHR2	Q13324	1/20	0.58

▸	GLP1R	P43220	10/20	0.56

▸	KEAP1	Q14145	1/20	0.56

▸	CCKBR	P32239	1/20	0.53

▸	F2	P00734	2/20	0.53

▸	PTH1R	Q03431	1/20	0.52

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
SCHEMBL29880253	0.97	CALCR (0.59)	CALCRCRHR1CRHR2GLP1RKEAP1
SCHEMBL31243563	0.93	GLP1R (0.60)	GLP1R
SCHEMBL31441459	0.92	KEAP1 (0.65)	GLP1RKEAP1CCKBR
SCHEMBL31265506	0.92	CALCR (0.60)	CALCRCRHR1CRHR2GLP1RCCKBR
SCHEMBL30956313	0.90	CALCR (0.50)	CALCRCRHR1CRHR2GLP1RKEAP1
SCHEMBL30956314	0.90	CALCR (0.50)	CALCRCRHR1CRHR2GLP1RKEAP1
SCHEMBL30504295	0.89	CALCR (0.52)	CALCRCRHR1CRHR2GLP1RKEAP1
SCHEMBL29880436	0.88	CALCR (0.60)	CALCRCRHR1CRHR2GLP1RCCKBR
SCHEMBL29726691	0.88	CALCR (0.60)	CALCRCRHR1CRHR2GLP1RCCKBR
SCHEMBL30778184	0.88	CALCR (0.60)	CALCRCRHR1CRHR2GLP1RCCKBR

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