SCHEMBL30495707

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

nearest known ligand 0.59

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	CCKBR	P32239	11/20	0.59

▸	OPRD1	P41143	3/20	0.59

▸	CCKAR	P32238	1/20	0.59

▸	OPRM1	P35372	2/20	0.58

▸	GLP1R	P43220	4/20	0.54

▸	KISS1R	Q969F8	1/20	0.51

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
SCHEMBL26080265	0.85	CCKBR (0.60)	CCKBROPRD1CCKAROPRM1GLP1R
SCHEMBL31664367	0.84	GLP1R (0.69)	CCKBRGLP1R
SCHEMBL26080285	0.84	NPBWR1 (0.64)	CCKBROPRD1CCKARGLP1R
SCHEMBL29981546	0.84	MAGI3 (0.53)	GLP1RKISS1R
SCHEMBL30261890	0.84	MAGI3 (0.53)	GLP1RKISS1R
SCHEMBL29982709	0.84	MAGI3 (0.53)	GLP1RKISS1R
SCHEMBL26080247	0.84	GLP1R (0.65)	CCKBRGLP1R
SCHEMBL26080253	0.84	GLP1R (0.67)	CCKBROPRD1CCKARGLP1R
SCHEMBL29443919	0.83	OPRM1 (0.63)	OPRD1OPRM1GLP1RKISS1R
SCHEMBL30690379	0.83	OPRD1 (0.60)	CCKBROPRD1CCKAROPRM1GLP1R

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
US-20230190887-A1	TARGETING G3BP AGGREGATION TO PREVENT NEURODEGENERATION	UNIVERSITY OF SOUTH CAROLINA (US)	2023-06-22	—	—	US	disclosed