SCHEMBL30433501

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

nearest known ligand 0.57

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	GRIN2D	O15399	1/20	0.57

▸	GRIN3B	O60391	1/20	0.57

▸	GRIN1	Q05586	1/20	0.57

▸	GRIN2A	Q12879	1/20	0.57

▸	GRIN2B	Q13224	1/20	0.57

▸	GRIN2C	Q14957	1/20	0.57

▸	GRIN3A	Q8TCU5	1/20	0.57

▸	TFPI	P10646	1/20	0.54

▸	RXFP1	Q9HBX9	2/20	0.53

▸	GLP1R	P43220	4/20	0.50

▸	PTH1R	Q03431	1/20	0.50

▸	BACE1	P56817	1/20	0.49

▸	VIPR1	P32241	1/20	0.48

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
SCHEMBL30262156	0.91	GRIN2D (0.58)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29777878	0.91	GRIN2D (0.55)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30432243	0.90	GRIN2D (0.54)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29639698	0.90	GRIN2D (0.55)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29677393	0.89	RXFP1 (0.58)	TFPIRXFP1GLP1RPTH1RVIPR1
SCHEMBL29777778	0.89	TFPI (0.54)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30543984	0.89	RXFP1 (0.53)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30608546	0.89	GLP1R (0.51)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29822714	0.88	RXFP1 (0.57)	TFPIRXFP1PTH1RVIPR1
SCHEMBL29671013	0.87	GRIN2D (0.55)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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