SCHEMBL30432741

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	VIPR1	P32241	6/20	0.62

▸	TFPI	P10646	1/20	0.59

▸	VIPR2	P41587	8/20	0.59

▸	NPY2R	P49146	8/20	0.58

▸	NPY4R	P50391	8/20	0.58

▸	NPY5R	Q15761	8/20	0.58

▸	NPY1R	P25929	6/20	0.58

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
SCHEMBL30432804	0.90	VIPR1 (0.70)	VIPR1TFPIVIPR2NPY2RNPY4R
SCHEMBL31430942	0.90	VIPR1 (0.55)	VIPR1TFPIVIPR2
SCHEMBL30567752	0.90	VIPR1 (0.59)	VIPR1TFPIVIPR2NPY2RNPY4R
SCHEMBL30463855	0.89	VIPR1 (0.66)	VIPR1TFPIVIPR2NPY2RNPY4R
SCHEMBL29962685	0.88	TFPI (0.66)	VIPR1TFPIVIPR2NPY2RNPY4R
SCHEMBL31430936	0.88	KISS1R (0.62)	VIPR1TFPIVIPR2
SCHEMBL30648453	0.87	TFPI (0.61)	VIPR1TFPIVIPR2NPY2RNPY4R
SCHEMBL29580583	0.87	VIPR2 (0.56)	VIPR1TFPIVIPR2NPY2RNPY4R
SCHEMBL31430946	0.87	VIPR1 (0.62)	VIPR1TFPIVIPR2
SCHEMBL29686242	0.87	KISS1R (0.62)	VIPR1TFPIVIPR2

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