SCHEMBL30432137

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CC(=O)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](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.55

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	PTH1R	Q03431	7/20	0.51

▸	GLP1R	P43220	2/20	0.49

▸	ECE1	P42892	1/20	0.49

▸	MUS81	Q96NY9	1/20	0.49

▸	RXFP1	Q9HBX9	2/20	0.49

▸	IL23R	Q5VWK5	1/20	0.49

▸	KEAP1	Q14145	1/20	0.48

▸	VIPR1	P32241	1/20	0.48

▸	CCKBR	P32239	1/20	0.47

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
SCHEMBL29447781	0.92	TASP1 (0.48)	PTH1RGLP1RECE1MUS81RXFP1
SCHEMBL30433492	0.91	PTH1R (0.57)	PTH1RGLP1RRXFP1VIPR1CCKBR
SCHEMBL30607454	0.90	RXFP1 (0.53)	PTH1RGLP1RRXFP1VIPR1CCKBR
SCHEMBL30159188	0.87	PTH1R (0.57)	PTH1RGLP1RRXFP1KEAP1VIPR1
SCHEMBL30179580	0.86	VIPR1 (0.53)	PTH1RGLP1RECE1MUS81RXFP1
SCHEMBL30449583	0.86	PTH1R (0.51)	PTH1RGLP1RRXFP1KEAP1VIPR1
SCHEMBL31295726	0.85	RXFP1 (0.52)	PTH1RGLP1RECE1MUS81RXFP1
SCHEMBL10335931	0.85	VIPR1 (0.46)	PTH1RRXFP1VIPR1
SCHEMBL9153365	0.85	RXFP1 (0.54)	PTH1RGLP1RECE1MUS81RXFP1
SCHEMBL30463856	0.85	RXFP1 (0.59)	PTH1RGLP1RRXFP1VIPR1CCKBR

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