SCHEMBL30432255

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.67

▸	CRHR1	P34998	1/20	0.65

▸	CRHR2	Q13324	1/20	0.65

▸	KEAP1	Q14145	1/20	0.64

▸	GLP1R	P43220	9/20	0.62

▸	GCGR	P47871	8/20	0.62

▸	GIPR	P48546	5/20	0.62

▸	APLNR	P35414	2/20	0.62

▸	F2	P00734	1/20	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
SCHEMBL31182915	0.92	CALCR (0.72)	CALCRCRHR1CRHR2KEAP1GLP1R
SCHEMBL31182535	0.92	CALCR (0.72)	CALCRCRHR1CRHR2KEAP1GLP1R
SCHEMBL31168252	0.91	CALCR (0.73)	CALCRCRHR1CRHR2KEAP1GLP1R
SCHEMBL30437439	0.91	CALCR (0.69)	CALCRCRHR1CRHR2KEAP1GLP1R
SCHEMBL30658226	0.90	CALCR (0.77)	CALCRCRHR1CRHR2KEAP1GLP1R
SCHEMBL30607275	0.90	CALCR (0.62)	CALCRCRHR1CRHR2KEAP1GLP1R
SCHEMBL30884870	0.90	CALCR (0.75)	CALCRCRHR1CRHR2KEAP1GLP1R
SCHEMBL31182545	0.89	CALCR (0.75)	CALCRCRHR1CRHR2KEAP1GLP1R
SCHEMBL31745603	0.89	CALCR (0.72)	CALCRCRHR1CRHR2KEAP1GLP1R
SCHEMBL30495716	0.89	CALCR (0.66)	CALCRCRHR1CRHR2KEAP1GLP1R

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