SCHEMBL30431350

CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C

nearest known ligand 0.73

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	OPRL1	P41146	5/20	0.59

▸	GLP1R	P43220	2/20	0.57

▸	GCGR	P47871	1/20	0.57

▸	GIPR	P48546	1/20	0.57

▸	TFPI	P10646	1/20	0.56

▸	PTH1R	Q03431	2/20	0.56

▸	CCKBR	P32239	1/20	0.54

▸	VIPR1	P32241	1/20	0.53

▸	NR3C1	P04150	1/20	0.53

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
SCHEMBL30358174	0.92	PTH1R (0.62)	OPRL1GLP1RPTH1RCCKBRVIPR1
Neuropeptide S SCHEMBL29464558	0.92	TFPI (0.61)	OPRL1GLP1RGCGRGIPRTFPI
SCHEMBL31182903	0.91	TFPI (0.65)	GLP1RGCGRGIPRTFPIPTH1R
SCHEMBL31678895	0.89	TFPI (0.60)	OPRL1GLP1RGCGRGIPRTFPI
SCHEMBL31038687	0.88	BACE1 (0.57)	GLP1RGCGRGIPRTFPIPTH1R
SCHEMBL29640388	0.88	TFPI (0.65)	GLP1RGCGRGIPRTFPIPTH1R
SCHEMBL30880908	0.88	VIPR1 (0.62)	OPRL1GLP1RTFPIPTH1RVIPR1
SCHEMBL30804674	0.88	BACE1 (0.58)	OPRL1GLP1RGCGRGIPRVIPR1
SCHEMBL30906463	0.88	TFPI (0.59)	GLP1RGCGRGIPRTFPIPTH1R
SCHEMBL30139095	0.88	PTH1R (0.59)	GLP1RPTH1RCCKBRVIPR1

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