SCHEMBL29664598

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

nearest known ligand 0.58

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	7/20	0.51

▸	RAMP3	O60896	5/20	0.51

▸	TFPI	P10646	4/20	0.50

▸	NPY2R	P49146	6/20	0.49

▸	NPY4R	P50391	6/20	0.49

▸	NPY5R	Q15761	6/20	0.49

▸	NPY1R	P25929	4/20	0.49

▸	CXCR4	P61073	2/20	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
SCHEMBL29664822	0.96	TFPI (0.50)	CALCRRAMP3TFPINPY2RNPY4R
SCHEMBL29679720	0.88	CXCR4 (0.49)	TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL30997396	0.87	RAMP3 (0.57)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL30930155	0.87	RAMP3 (0.57)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL30522715	0.87	CXCR4 (0.50)	CALCRTFPINPY2RNPY4RNPY5R
SCHEMBL30401193	0.87	NPY2R (0.52)	CALCRRAMP3TFPINPY2RNPY4R
SCHEMBL30402066	0.87	NPY2R (0.52)	CALCRRAMP3TFPINPY2RNPY4R
SCHEMBL29777837	0.86	RAMP3 (0.54)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL30102119	0.86	RAMP3 (0.47)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL30432302	0.86	NPY2R (0.53)	CALCRRAMP3TFPINPY2RNPY4R

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-20220162273-A1	LEECH POLYPEPTIDE AND USE THEREOF	SHANDONG UNIVERSITY (CN)	2022-05-26	—	—	US	disclosed