SCHEMBL29526997

CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O

nearest known ligand 0.72

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	10/20	0.72

▸	NPY1R	P25929	9/20	0.72

▸	NPY4R	P50391	8/20	0.72

▸	NPY5R	Q15761	8/20	0.72

▸	CALCR	P30988	5/20	0.65

▸	TFPI	P10646	1/20	0.63

▸	RAMP3	O60896	1/20	0.62

▸	HCRTR1	O43613	1/20	0.62

▸	HCRTR2	O43614	1/20	0.62

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
SCHEMBL29496391	0.96	NPY2R (0.72)	NPY2RNPY1RNPY4RNPY5RCALCR
SCHEMBL29854496	0.96	NPY2R (0.68)	NPY2RNPY1RNPY4RNPY5RCALCR
SCHEMBL29496288	0.93	NPY2R (0.74)	NPY2RNPY1RNPY4RNPY5RCALCR
SCHEMBL29397746	0.93	NPY2R (0.73)	NPY2RNPY1RNPY4RNPY5RCALCR
SCHEMBL29571016	0.93	NPY2R (0.70)	NPY2RNPY1RNPY4RNPY5RCALCR
Human Neuropeptide Y SCHEMBL29523348	0.92	CALCR (0.72)	NPY2RNPY1RNPY4RNPY5RCALCR
SCHEMBL13248707	0.91	NPY2R (0.80)	NPY2RNPY1RNPY4RNPY5RCALCR
SCHEMBL31362091	0.90	CRHR1 (0.69)	NPY2RNPY1RNPY4RNPY5RCALCR
SCHEMBL30436793	0.90	NPY2R (0.63)	NPY2RNPY1RNPY4RNPY5RCALCR
SCHEMBL30436896	0.90	CALCR (0.68)	NPY2RNPY1RNPY4RNPY5RCALCR

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
EP-3983434-A1	APPETITE SUPPRESSING COMPOUNDS	IP2IPO Innovations Limited (GB)	2022-04-20	—	—	EP	disclosed