SCHEMBL30432302

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

nearest known ligand 0.57

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	8/20	0.53

▸	NPY4R	P50391	8/20	0.53

▸	NPY5R	Q15761	8/20	0.53

▸	CALCR	P30988	8/20	0.53

▸	RAMP3	O60896	7/20	0.53

▸	NPY1R	P25929	6/20	0.53

▸	TFPI	P10646	1/20	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
SCHEMBL30906563	0.90	CALCR (0.52)	NPY2RNPY4RNPY5RCALCRRAMP3
SCHEMBL30401005	0.87	KDM1A (0.50)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30432133	0.87	RAMP3 (0.56)	NPY2RNPY4RNPY5RCALCRRAMP3
SCHEMBL30997388	0.86	NPY2R (0.54)	NPY2RNPY4RNPY5RCALCRRAMP3
SCHEMBL30930170	0.86	NPY2R (0.54)	NPY2RNPY4RNPY5RCALCRRAMP3
SCHEMBL30906472	0.86	EP300 (0.54)	NPY2RNPY4RNPY5RCALCRNPY1R
SCHEMBL29664598	0.86	CALCR (0.51)	NPY2RNPY4RNPY5RCALCRRAMP3
SCHEMBL30930143	0.86	NPY2R (0.48)	NPY2RNPY4RNPY5RCALCRRAMP3
SCHEMBL31031609	0.86	NPY2R (0.54)	NPY2RNPY4RNPY5RCALCRRAMP3
SCHEMBL30433577	0.86	NPY2R (0.53)	NPY2RNPY4RNPY5RCALCRRAMP3

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-20240342111-A1	ISOMER-SPECIFIC NEUROPROTECTIVE EFFECT OF NATURAL RESERVATROL	UNIV SOUTH CAROLINA (US)	2024-10-17	—	—	US	disclosed
US-20230201133-A1	Isomer-Specific Neuroprotective Effect of Natural Resveratrol	UNIVERSITY OF SOUTH CAROLINA (US)	2023-06-29	—	—	US	disclosed