SCHEMBL29678210

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

nearest known ligand 0.58

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	NPY1R	P25929	1/20	0.58

▸	NPY2R	P49146	1/20	0.58

▸	NPY4R	P50391	1/20	0.58

▸	NPY5R	Q15761	1/20	0.58

▸	CALCRL	Q16602	1/20	0.55

▸	NTSR2	O95665	15/20	0.54

▸	NTSR1	P30989	15/20	0.54

▸	SORT1	Q99523	13/20	0.54

▸	SLC6A2	P23975	1/20	0.53

▸	OPRM1	P35372	1/20	0.52

▸	OPRD1	P41143	1/20	0.52

▸	OPRK1	P41145	1/20	0.52

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
SCHEMBL29678167	0.89	CAPN1 (0.48)	NPY1RNPY2RNPY4RNPY5RCALCRL
SCHEMBL29678075	0.84	MAPK8 (0.47)	CALCRLNTSR2NTSR1SORT1
SCHEMBL29976151	0.83	CALCRL (0.44)	CALCRLNTSR2NTSR1SORT1
SCHEMBL31472961	0.83	NTSR1 (0.63)	NTSR2NTSR1SORT1OPRM1OPRD1
SCHEMBL30607280	0.83	CALCR (0.59)	NPY1RNPY2RNPY4RNPY5RCALCRL
SCHEMBL30567788	0.83	EP300 (0.58)	NPY1RNPY2RNPY4RNPY5RNTSR2
SCHEMBL31233933	0.81	SLC6A2 (0.61)	CALCRLNTSR2NTSR1SORT1SLC6A2
SCHEMBL31233948	0.81	SLC6A2 (0.61)	CALCRLNTSR2NTSR1SORT1SLC6A2
SCHEMBL31679338	0.81	SLC6A2 (0.60)	NTSR2NTSR1SORT1SLC6A2OPRM1
SCHEMBL31257015	0.81	SLC6A2 (0.62)	CALCRLNTSR2NTSR1SORT1SLC6A2

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
EP-4003403-A1	RECEPTOR-TARGETING PEPTIDE-DRUG CONJUGATES	Molgenie GmbH (DE)	2022-06-01	—	—	EP	claimed