SCHEMBL30432575

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

nearest known ligand 0.55

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	12/20	0.51

▸	RAMP3	O60896	8/20	0.51

▸	NPY2R	P49146	7/20	0.50

▸	NPY4R	P50391	7/20	0.50

▸	NPY5R	Q15761	7/20	0.50

▸	NPY1R	P25929	5/20	0.50

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
SCHEMBL31461848	0.90	CALCR (0.53)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL31461901	0.90	CALCR (0.52)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL30495643	0.86	NPY2R (0.63)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL30198507	0.86	NPY2R (0.48)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL31462127	0.86	EP300 (0.48)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL31182476	0.85	EP300 (0.53)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30607405	0.84	NPY2R (0.60)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30906499	0.84	NPY2R (0.51)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL30524360	0.84	F2 (0.53)	CALCRRAMP3NPY2RNPY4RNPY5R
SCHEMBL31461892	0.84	CALCR (0.53)	CALCRRAMP3NPY2RNPY4RNPY5R

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