SCHEMBL30433111

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

nearest known ligand 0.51

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	OPRL1	P41146	6/20	0.51

▸	KEAP1	Q14145	2/20	0.49

▸	TFPI	P10646	1/20	0.46

▸	VIPR1	P32241	1/20	0.43

▸	VIPR2	P41587	1/20	0.43

▸	RAMP3	O60896	3/20	0.43

▸	CALCR	P30988	3/20	0.43

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
SCHEMBL30431362	0.91	OPRL1 (0.54)	OPRL1TFPIVIPR1RAMP3CALCR
SCHEMBL31211745	0.90	FOLH1 (0.45)	OPRL1KEAP1TFPI
SCHEMBL30186434	0.90	IL23R (0.44)	OPRL1KEAP1TFPI
SCHEMBL29867622	0.89	TFPI (0.50)	OPRL1TFPIVIPR1VIPR2
SCHEMBL29736066	0.89	KEAP1 (0.49)	OPRL1KEAP1TFPIVIPR1VIPR2
SCHEMBL29417287	0.89	VIPR2 (0.49)	OPRL1KEAP1TFPIVIPR1VIPR2
SCHEMBL31676591	0.89	TFPI (0.45)	OPRL1TFPI
SCHEMBL31676593	0.89	TFPI (0.45)	OPRL1TFPI
SCHEMBL30844336	0.88	RXFP1 (0.54)	OPRL1TFPIVIPR1VIPR2
SCHEMBL29736155	0.88	TFPI (0.49)	OPRL1KEAP1TFPIVIPR1

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