SCHEMBL30435868

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.63

▸	GLP1R	P43220	13/20	0.61

▸	SCTR	P47872	1/20	0.61

▸	VIPR1	P32241	1/20	0.57

▸	GCGR	P47871	1/20	0.57

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
SCHEMBL29594112	0.94	GLP1R (0.58)	TFPIGLP1RSCTRVIPR1GCGR
SCHEMBL30495762	0.93	GLP1R (0.69)	TFPIGLP1RSCTRGCGR
SCHEMBL31182719	0.92	GLP1R (0.68)	TFPIGLP1RSCTRVIPR1GCGR
SCHEMBL29637838	0.91	GLP1R (0.58)	TFPIGLP1RSCTRGCGR
SCHEMBL30620994	0.91	GLP1R (0.68)	GLP1RSCTRGCGR
SCHEMBL31719707	0.90	GLP1R (0.59)	TFPIGLP1RSCTRGCGR
SCHEMBL30576943	0.90	GLP1R (0.64)	GLP1RSCTRVIPR1
SCHEMBL8973690	0.90	GLP1R (0.60)	TFPIGLP1RSCTRGCGR
SCHEMBL30887561	0.89	GLP1R (0.62)	GLP1RSCTRVIPR1
SCHEMBL31571739	0.89	GLP1R (0.70)	GLP1RSCTRGCGR

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-114395545-B	Sialidase for resisting helicobacter pylori colonization in stomach	成都欧林生物科技股份有限公司	2023-05-12	—	—	CN	disclosed