SCHEMBL30431998

CC(C)C[C@H](NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)O)C(C)C)C(C)C)C(C)C)[C@@H](C)O

nearest known ligand 0.50

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.50

▸	GRIN2D	O15399	1/20	0.47

▸	GRIN3B	O60391	1/20	0.47

▸	GRIN1	Q05586	1/20	0.47

▸	GRIN2A	Q12879	1/20	0.47

▸	GRIN2B	Q13224	1/20	0.47

▸	GRIN2C	Q14957	1/20	0.47

▸	GRIN3A	Q8TCU5	1/20	0.47

▸	GLP1R	P43220	4/20	0.46

▸	ERBB2	P04626	1/20	0.45

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
SCHEMBL30432037	0.86	GRIN2D (0.55)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30431667	0.86	TFPI (0.59)	TFPI
SCHEMBL30437164	0.85	RXFP1 (0.49)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30069083	0.85	TFPI (0.52)	TFPI
SCHEMBL30432423	0.85	TFPI (0.61)	TFPIGLP1R
SCHEMBL30432511	0.85	TFPI (0.52)	TFPIGLP1R
SCHEMBL29350435	0.84	BACE1 (0.53)	—
SCHEMBL30069130	0.84	TFPI (0.50)	TFPIGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30069080	0.84	TFPI (0.50)	TFPIGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL31182448	0.83	TFPI (0.60)	TFPIGLP1R

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