SCHEMBL30428990

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O

nearest known ligand 0.64

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	11/20	0.61

▸	CALCR	P30988	11/20	0.61

▸	NPY2R	P49146	7/20	0.59

▸	NPY4R	P50391	7/20	0.59

▸	NPY5R	Q15761	7/20	0.59

▸	NPY1R	P25929	5/20	0.59

▸	CXCR4	P61073	1/20	0.59

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
SCHEMBL30567708	0.92	NPY2R (0.61)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31474426	0.91	RAMP3 (0.61)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30432133	0.90	RAMP3 (0.56)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30906350	0.90	NPY2R (0.59)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29679604	0.90	RAMP3 (0.57)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30607335	0.89	RAMP3 (0.59)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29679682	0.89	NMUR2 (0.61)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29679877	0.89	RAMP3 (0.61)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL8937114	0.88	NPY2R (0.58)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL8937058	0.88	NPY2R (0.58)	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