SCHEMBL7930386

CC(C)(CC(=O)N[C@@H]1CCc2c(ccc3ccccc23)N(Cc2ccc(-c3ccccc3CNC(=O)OC(C)(C)C)cc2)C1=O)NC(=O)OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	GHSR	Q92847	4/20	0.45

▸	AGTR1	P30556	1/20	0.41

▸	NPY1R	P25929	1/20	0.38

▸	XIAP	P98170	6/20	0.36

▸	PTGER1	P34995	1/20	0.35

▸	PTGER4	P35408	1/20	0.35

▸	PTGER3	P43115	1/20	0.35

▸	PTGER2	P43116	1/20	0.35

▸	CCKBR	P32239	1/20	0.35

▸	SCN9A	Q15858	2/20	0.34

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
SCHEMBL7923935	0.91	GHSR (0.44)	GHSRAGTR1NPY1RXIAPPTGER1
SCHEMBL9091131	0.89	GHSR (0.58)	GHSRAGTR1NPY1RXIAPPTGER1
SCHEMBL9025448	0.81	GHSR (0.55)	GHSRAGTR1NPY1RXIAPPTGER1
SCHEMBL8329662	0.81	GHSR (0.69)	GHSRAGTR1NPY1RXIAPPTGER1
SCHEMBL8331766	0.80	GHSR (0.63)	GHSRAGTR1NPY1RXIAPPTGER1
SCHEMBL8719345	0.80	GHSR (0.45)	GHSRAGTR1NPY1RXIAPCCKBR
SCHEMBL7794392	0.79	GHSR (0.64)	GHSRAGTR1NPY1RXIAPPTGER1
SCHEMBL7794388	0.79	GHSR (0.64)	GHSRAGTR1NPY1RXIAPPTGER1
SCHEMBL9087738	0.79	GHSR (0.56)	GHSRAGTR1NPY1RXIAPPTGER1
SCHEMBL9090948	0.78	GHSR (0.56)	GHSRAGTR1NPY1RXIAPSCN9A

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-6211174-B1	OSTEOPOROSIS; MILK PRODUCTION AND CARCASS QUALITY IN LIVESTOCK; SHORT STATURE; METABOLIC DISORDERS	MERCK & CO., INC.	2001-04-03	—	—	US	disclosed