SCHEMBL30512538

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

nearest known ligand 0.50

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	7/20	0.50

▸	CALCR	P30988	7/20	0.50

▸	KDM1A	O60341	3/20	0.49

▸	CXCR4	P61073	1/20	0.49

▸	NPY2R	P49146	7/20	0.49

▸	NPY4R	P50391	7/20	0.49

▸	NPY5R	Q15761	7/20	0.49

▸	NPY1R	P25929	5/20	0.49

▸	MAOB	P27338	1/20	0.49

▸	KDM5A	P29375	1/20	0.49

▸	KDM1B	Q8NB78	1/20	0.49

▸	APLNR	P35414	1/20	0.49

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
SCHEMBL30567704	0.90	CALCR (0.54)	CALCRCXCR4NPY2RNPY4RNPY5R
SCHEMBL29515091	0.88	KDM1A (0.55)	KDM1ACXCR4NPY2RNPY4RNPY5R
SCHEMBL29473687	0.87	MAPK8 (0.56)	CALCRKDM1ACXCR4NPY2RNPY4R
SCHEMBL30432061	0.87	NPY2R (0.57)	RAMP3CALCRCXCR4NPY2RNPY4R
SCHEMBL31410874	0.87	RAMP3 (0.53)	RAMP3CALCR
SCHEMBL31033326	0.86	RAMP3 (0.47)	RAMP3CALCRAPLNR
SCHEMBL29706186	0.86	RAMP3 (0.51)	RAMP3CALCRKDM1ACXCR4NPY2R
SCHEMBL30432923	0.86	RAMP3 (0.53)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30906340	0.85	NPY2R (0.57)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30320583	0.85	RAMP3 (0.52)	RAMP3CALCR

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-116490215-A	Targeted mediated endocytic drug delivery	CRM医疗有限公司	2023-07-25	—	—	CN	disclosed