SCHEMBL30690322

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(C)C)C(C)C

nearest known ligand 0.63

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	2/20	0.63

▸	OPRD1	P41143	2/20	0.63

▸	NPBWR1	P48145	10/20	0.61

▸	GLP1R	P43220	7/20	0.59

▸	ECE1	P42892	1/20	0.59

▸	MUS81	Q96NY9	1/20	0.59

▸	KISS1R	Q969F8	1/20	0.58

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
SCHEMBL29443919	0.98	OPRM1 (0.63)	OPRM1OPRD1NPBWR1GLP1RECE1
SCHEMBL30690379	0.97	OPRD1 (0.60)	OPRM1OPRD1NPBWR1GLP1RECE1
SCHEMBL30690385	0.96	OPRM1 (0.61)	OPRM1OPRD1NPBWR1GLP1RECE1
SCHEMBL29443914	0.94	GLP1R (0.61)	OPRM1OPRD1NPBWR1GLP1RECE1
SCHEMBL29443911	0.94	GLP1R (0.62)	OPRM1OPRD1NPBWR1GLP1RECE1
SCHEMBL30690390	0.93	GLP1R (0.61)	OPRM1OPRD1NPBWR1GLP1RECE1
SCHEMBL30690352	0.93	GLP1R (0.62)	OPRM1OPRD1NPBWR1GLP1RECE1
SCHEMBL30690338	0.93	GLP1R (0.62)	OPRM1OPRD1NPBWR1GLP1RECE1
SCHEMBL30690358	0.91	GLP1R (0.66)	OPRD1GLP1RECE1MUS81
SCHEMBL30690372	0.91	GLP1R (0.66)	OPRD1GLP1RECE1MUS81

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-110041432-B	chimeric antigen receptor	细胞基因公司	2023-12-05	—	—	CN	disclosed