SCHEMBL30429026

C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O

nearest known ligand 0.58

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	7/20	0.58

▸	CALCR	P30988	7/20	0.58

▸	MAPK8	P45983	1/20	0.57

▸	MAPK9	P45984	1/20	0.57

▸	MAPK10	P53779	1/20	0.57

▸	NPY2R	P49146	8/20	0.56

▸	NPY4R	P50391	8/20	0.56

▸	NPY5R	Q15761	8/20	0.56

▸	NPY1R	P25929	6/20	0.56

▸	RAMP1	O60894	1/20	0.55

▸	CALCRL	Q16602	1/20	0.55

▸	NMUR2	Q9GZQ4	1/20	0.54

▸	NMUR1	Q9HB89	1/20	0.54

▸	KEAP1	Q14145	1/20	0.54

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
SCHEMBL29614950	0.90	RAMP3 (0.63)	RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL31182526	0.87	GLP1R (0.60)	CALCRKEAP1
SCHEMBL30906523	0.87	MAPK8 (0.62)	RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL30906494	0.87	NPY2R (0.62)	RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL30198913	0.86	KEAP1 (0.63)	RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL30176425	0.86	NPY2R (0.64)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30974050	0.86	EPHA2 (0.58)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31191386	0.86	MAPK8 (0.56)	RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL29617368	0.86	MAPK8 (0.56)	MAPK8MAPK9MAPK10NPY2RNPY4R
SCHEMBL30973990	0.85	EPHA2 (0.60)	RAMP3CALCRNPY2RNPY4RNPY5R

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-20230165951-A1	Engineering, production and characterization of plant produced Nucleocapsid and Spike structural proteins of SARS CoV 2 as vaccine candidates against COVID19	MAMEDOV TARLAN (TR)	2023-06-01	—	—	US	disclosed