SCHEMBL29809975

CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C

nearest known ligand 0.66

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	3/20	0.59

▸	TFPI	P10646	4/20	0.57

▸	NPY2R	P49146	5/20	0.56

▸	NPY4R	P50391	5/20	0.56

▸	NPY5R	Q15761	5/20	0.56

▸	NPY1R	P25929	4/20	0.56

▸	OPRM1	P35372	2/20	0.55

▸	OPRD1	P41143	2/20	0.55

▸	OPRK1	P41145	2/20	0.55

▸	KDM1A	O60341	1/20	0.55

▸	CRHR1	P34998	1/20	0.55

▸	CRHR2	Q13324	1/20	0.55

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
SCHEMBL31005072	0.91	OPRD1 (0.60)	TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL29461492	0.90	NPY2R (0.64)	CALCRTFPINPY2RNPY4RNPY5R
SCHEMBL31548693	0.90	CALCRL (0.59)	—
SCHEMBL31005057	0.89	NPY2R (0.59)	CALCRTFPINPY2RNPY4RNPY5R
SCHEMBL11652679	0.88	CALCR (0.65)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL29533837	0.88	CALCR (0.65)	CALCRTFPIOPRM1OPRD1OPRK1
SCHEMBL31182475	0.88	CALCR (0.67)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30567770	0.88	CALCR (0.60)	CALCRTFPINPY2RNPY4RNPY5R
SCHEMBL30974357	0.88	NTSR1 (0.57)	OPRM1OPRD1OPRK1
SCHEMBL11651841	0.88	CALCR (0.65)	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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-110317246-B	Human MOG epitope peptide, antigen, antibody, application and chemiluminescence kit	深圳市安群生物工程有限公司	2022-08-02	—	—	CN	claimed
CN-110317246-B	Human MOG epitope peptide, antigen, antibody, application and chemiluminescence kit	深圳市安群生物工程有限公司	2022-08-02	—	—	CN	disclosed