SCHEMBL30436896

CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O

nearest known ligand 0.71

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	5/20	0.68

▸	NPY2R	P49146	7/20	0.66

▸	NPY4R	P50391	7/20	0.66

▸	NPY5R	Q15761	7/20	0.66

▸	NPY1R	P25929	5/20	0.66

▸	GLP1R	P43220	3/20	0.65

▸	GCGR	P47871	3/20	0.65

▸	RAMP3	O60896	1/20	0.65

▸	C5AR1	P21730	1/20	0.65

▸	MC4R	P32245	1/20	0.64

▸	TFPI	P10646	1/20	0.64

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
SCHEMBL31182654	0.94	NPY2R (0.66)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30495793	0.93	CALCR (0.67)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31182738	0.92	CALCR (0.67)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL29592959	0.92	CALCR (0.79)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31182473	0.91	NPY2R (0.70)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30511759	0.91	CALCR (0.66)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30432646	0.91	CALCR (0.67)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31182502	0.91	CALCR (0.73)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30818412	0.91	CALCR (0.69)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30818413	0.91	CALCR (0.69)	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-20230167470-A1	METHOD AND STRAINS FOR REDUCING BYPRODUCT SUCCINIC ACID IN FERMENTATION PROCESS OF L-MALIC ACID AND USE THEREOF	Nanjing Haohe Biotechnology Co., Ltd. (CN)	2023-06-01	—	—	US	disclosed