SCHEMBL30350066

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	VIPR1	P32241	4/20	0.65

▸	VIPR2	P41587	6/20	0.64

▸	TFPI	P10646	1/20	0.64

▸	KISS1R	Q969F8	3/20	0.62

▸	GLP1R	P43220	1/20	0.58

▸	GCGR	P47871	1/20	0.58

▸	GIPR	P48546	1/20	0.58

▸	NPY4R	P50391	3/20	0.57

▸	NPY1R	P25929	2/20	0.57

▸	NPY2R	P49146	2/20	0.57

▸	NPY5R	Q15761	2/20	0.57

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
SCHEMBL29939512	0.94	GLP1R (0.65)	VIPR1VIPR2TFPIKISS1RGLP1R
SCHEMBL29453341	0.92	VIPR1 (0.72)	VIPR1VIPR2TFPIKISS1RGLP1R
SCHEMBL29453357	0.92	VIPR2 (0.70)	VIPR1VIPR2TFPIGLP1RGCGR
SCHEMBL29453348	0.91	VIPR2 (0.70)	VIPR1VIPR2TFPIKISS1R
SCHEMBL30176472	0.91	VIPR1 (0.61)	VIPR1VIPR2TFPIGLP1RGCGR
SCHEMBL29550386	0.91	TFPI (0.59)	VIPR1VIPR2TFPIKISS1RGLP1R
SCHEMBL30771537	0.91	TFPI (0.59)	VIPR1VIPR2TFPIKISS1RGLP1R
SCHEMBL30512630	0.91	NPY4R (0.63)	VIPR1VIPR2TFPINPY4RNPY1R
SCHEMBL30974419	0.91	NPY4R (0.64)	VIPR1VIPR2TFPINPY4RNPY1R
SCHEMBL31676914	0.90	VIPR1 (0.63)	VIPR1VIPR2TFPIKISS1RGLP1R

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-115925960-A	Antibody or antigen binding fragment capable of being specifically bound with creatine kinase isoenzyme and application thereof	杭州傲锐生物医药科技有限公司	2023-04-07	—	—	CN	disclosed