SCHEMBL7464387

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

nearest known ligand 0.58

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	NPY4R	P50391	13/20	0.58

▸	NPY1R	P25929	8/20	0.58

▸	NPY5R	Q15761	7/20	0.58

▸	NPY2R	P49146	5/20	0.58

▸	NPBWR1	P48145	2/20	0.51

▸	KISS1R	Q969F8	4/20	0.51

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
SCHEMBL8723128	0.87	NPY4R (0.53)	NPY4RNPY1RNPY5RNPY2RNPBWR1
SCHEMBL8723157	0.87	NPY4R (0.53)	NPY4RNPY1RNPY5RNPY2RNPBWR1
SCHEMBL30924727	0.86	TFPI (0.54)	NPY4RNPY1RNPY2RKISS1R
SCHEMBL31433295	0.85	NPY5R (0.58)	NPY4RNPY1RNPY5RNPY2RNPBWR1
SCHEMBL31409435	0.85	KISS1R (0.59)	KISS1R
SCHEMBL30617733	0.84	NPY4R (0.56)	NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL30706502	0.82	NPY4R (0.60)	NPY4RNPY1RNPY5RNPY2R
SCHEMBL30838805	0.82	NPY4R (0.53)	NPY4RNPY1RNPY5RNPY2R
SCHEMBL31409437	0.82	KISS1R (0.59)	NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL31353030	0.82	NPY4R (0.57)	NPY4RNPY1RNPY5RNPY2RNPBWR1

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
US-5710123-A	POLYPEPTIDES AND NONAPEPTIDES AS ANTISTICKING AGENTS AND INHIBITORS OF LEUKOCYTE ADHESION	CENTOCOR, INC. (US)	1998-01-20	—	—	US	disclosed
WO-1994014836-A1	PEPTIDE INHIBITORS OF SELECTIN BINDING	CENTOCOR, INC. (US)	1994-07-07	—	—	WO	disclosed