SCHEMBL31256981

CC(C)C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C

nearest known ligand 0.54

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	2/20	0.53

▸	SLC6A2	P23975	1/20	0.53

▸	NTSR2	O95665	4/20	0.52

▸	NTSR1	P30989	4/20	0.52

▸	SORT1	Q99523	3/20	0.51

▸	CALCRL	Q16602	1/20	0.51

▸	EPHA2	P29317	1/20	0.50

▸	OPRM1	P35372	1/20	0.50

▸	OPRD1	P41143	1/20	0.50

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
SCHEMBL31256951	0.90	NTSR1 (0.57)	NTSR2NTSR1SORT1
SCHEMBL30123059	0.87	CALCRL (0.61)	SLC6A2CALCRL
SCHEMBL30234221	0.85	NTSR2 (0.54)	SLC6A2NTSR2NTSR1SORT1OPRM1
SCHEMBL31373856	0.85	F2 (0.56)	RENSLC6A2NTSR2NTSR1OPRM1
SCHEMBL31013476	0.85	SLC6A2 (0.61)	SLC6A2OPRM1OPRD1
SCHEMBL31013463	0.85	SLC6A2 (0.61)	SLC6A2OPRM1OPRD1
SCHEMBL31356484	0.85	SLC6A2 (0.63)	RENSLC6A2NTSR2NTSR1SORT1
SCHEMBL31356486	0.85	SLC6A2 (0.63)	RENSLC6A2NTSR2NTSR1SORT1
SCHEMBL29592515	0.84	OPRM1 (0.59)	SLC6A2OPRM1OPRD1
SCHEMBL31241525	0.84	NMUR2 (0.55)	SLC6A2NTSR2NTSR1SORT1OPRM1

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-20240352445-A1	HUMANIZATION, AFFINITY MATURATION, AND OPTIMIZATION METHODS FOR PROTEINS AND ANTIBODIES	ABWIZ BIO, INC.	2024-10-24	—	—	US	disclosed