SCHEMBL29949412

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

nearest known ligand 0.54

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	14/20	0.53

▸	CALCR	P30988	14/20	0.53

▸	NPY2R	P49146	5/20	0.51

▸	NPY4R	P50391	5/20	0.51

▸	NPY5R	Q15761	5/20	0.51

▸	NPY1R	P25929	3/20	0.51

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
SCHEMBL30432133	0.90	RAMP3 (0.56)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30349254	0.88	RAMP3 (0.52)	RAMP3CALCR
SCHEMBL30437145	0.87	RAMP3 (0.59)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30930139	0.87	CALCR (0.56)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30567780	0.86	F2 (0.60)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30495688	0.86	NPY2R (0.50)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30428990	0.86	RAMP3 (0.61)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31031609	0.85	NPY2R (0.54)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30262183	0.85	NPY2R (0.54)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31031586	0.85	NPY2R (0.54)	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
CN-113308448-B	Rice leaf color regulation gene WSS1 and encoding protein and application thereof	中国农业科学院作物科学研究所	2022-11-18	—	—	CN	disclosed