SCHEMBL30432907

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)CC

nearest known ligand 0.54

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	VIPR1	P32241	4/20	0.53

▸	VIPR2	P41587	6/20	0.52

▸	PTH1R	Q03431	4/20	0.51

▸	GRIN2D	O15399	1/20	0.50

▸	GRIN3B	O60391	1/20	0.50

▸	GRIN1	Q05586	1/20	0.50

▸	GRIN2A	Q12879	1/20	0.50

▸	GRIN2B	Q13224	1/20	0.50

▸	GRIN2C	Q14957	1/20	0.50

▸	GRIN3A	Q8TCU5	1/20	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
SCHEMBL30140921	0.90	TFPI (0.48)	VIPR1VIPR2PTH1RGRIN2DGRIN3B
SCHEMBL30262186	0.90	VIPR2 (0.54)	VIPR1VIPR2PTH1RGRIN2DGRIN3B
SCHEMBL30567452	0.88	TFPI (0.58)	VIPR1VIPR2PTH1RGRIN2DGRIN3B
SCHEMBL29677337	0.88	RXFP1 (0.55)	VIPR1VIPR2PTH1R
SCHEMBL30261997	0.87	VIPR1 (0.60)	VIPR1VIPR2
SCHEMBL38662566	0.87	VIPR2 (0.51)	VIPR1VIPR2
SCHEMBL30648442	0.87	GRIN2D (0.50)	VIPR1VIPR2GRIN2DGRIN3BGRIN1
SCHEMBL30648496	0.87	GRIN2D (0.50)	VIPR1VIPR2GRIN2DGRIN3BGRIN1
SCHEMBL30863950	0.87	TASP1 (0.49)	VIPR1VIPR2PTH1RGRIN2DGRIN3B
SCHEMBL31287215	0.86	GRIN2D (0.53)	VIPR1VIPR2PTH1RGRIN2DGRIN3B

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