SCHEMBL31087277

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)O

nearest known ligand 0.79

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	15/20	0.74

▸	GCGR	P47871	9/20	0.74

▸	GIPR	P48546	6/20	0.74

▸	KEAP1	Q14145	1/20	0.70

▸	CALCR	P30988	2/20	0.67

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
SCHEMBL29922593	0.98	GLP1R (0.77)	GLP1RGCGRGIPRKEAP1CALCR
SCHEMBL29922218	0.98	GLP1R (0.77)	GLP1RGCGRGIPRKEAP1
SCHEMBL873516	0.97	GLP1R (0.72)	GLP1RGCGRGIPRKEAP1CALCR
SCHEMBL30331625	0.97	GLP1R (0.71)	GLP1RGCGRGIPRKEAP1
SCHEMBL30422908	0.97	GLP1R (0.73)	GLP1RGCGRGIPRKEAP1CALCR
SCHEMBL30423442	0.97	GLP1R (0.73)	GLP1RGCGRGIPRKEAP1CALCR
SCHEMBL30423071	0.97	GLP1R (0.73)	GLP1RGCGRGIPRKEAP1CALCR
SCHEMBL31454131	0.97	GLP1R (0.76)	GLP1RGCGRGIPRKEAP1CALCR
SCHEMBL30422794	0.96	GLP1R (0.74)	GLP1RGCGRGIPRKEAP1CALCR
SCHEMBL29536792	0.96	GLP1R (0.75)	GLP1RGCGRGIPRKEAP1CALCR

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-118541170-A	Ionic liquid composition	I2O治疗公司	2024-08-23	—	—	CN	disclosed