SCHEMBL30262139

CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.63

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.59

▸	NPY2R	P49146	8/20	0.57

▸	NPY4R	P50391	8/20	0.57

▸	NPY5R	Q15761	8/20	0.57

▸	NPY1R	P25929	6/20	0.57

▸	OPRD1	P41143	1/20	0.55

▸	GLP1R	P43220	1/20	0.53

▸	GCGR	P47871	1/20	0.53

▸	GIPR	P48546	1/20	0.53

▸	TFPI	P10646	1/20	0.53

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
SCHEMBL30262040	0.91	CALCR (0.59)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30432350	0.89	CALCR (0.60)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31182524	0.88	CALCR (0.61)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31000912	0.88	CALCR (0.54)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL29811064	0.88	CALCR (0.66)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL29461428	0.88	NTSR1 (0.59)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL29416782	0.87	CALCR (0.62)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31182956	0.87	NPY2R (0.65)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30495626	0.87	NPY2R (0.68)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30176420	0.87	NPY2R (0.68)	CALCRNPY2RNPY4RNPY5RNPY1R

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-20230040544-A1	COMPOSITIONS AND METHODS FOR RESTORING AND MAINTAINING THE DYSTROPHIN-ASSOCIATED PROTEIN COMPLEX (DAPC)	SAREPTA THERAPEUTICS, INC.	2023-02-09	—	—	US	disclosed