SCHEMBL30431281

CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	F2	P00734	4/20	0.59

▸	NMBR	P28336	2/20	0.56

▸	GRPR	P30550	2/20	0.56

▸	CALCR	P30988	5/20	0.56

▸	MC4R	P32245	1/20	0.54

▸	C5AR1	P21730	2/20	0.53

▸	CRHR1	P34998	1/20	0.52

▸	CRHR2	Q13324	1/20	0.52

▸	HCRTR1	O43613	1/20	0.52

▸	HCRTR2	O43614	1/20	0.52

▸	FCGRT	P55899	2/20	0.51

▸	RAMP3	O60896	1/20	0.50

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
SCHEMBL30432714	0.87	CALCR (0.67)	F2CALCRCRHR1CRHR2HCRTR1
SCHEMBL31182654	0.85	NPY2R (0.66)	CALCRC5AR1RAMP3
SCHEMBL30712912	0.85	F2 (0.64)	F2CALCRMC4RC5AR1RAMP3
SCHEMBL29629120	0.85	MC4R (0.62)	F2NMBRGRPRCALCRMC4R
SCHEMBL29629130	0.85	MC4R (0.62)	F2NMBRGRPRCALCRMC4R
SCHEMBL30383056	0.84	F2 (0.53)	F2NMBRGRPRMC4RC5AR1
SCHEMBL31169469	0.84	C5AR1 (0.61)	F2CALCRMC4RC5AR1RAMP3
SCHEMBL30978823	0.84	F2 (0.58)	F2NMBRGRPRCALCRMC4R
SCHEMBL31683370	0.84	CALCR (0.70)	F2CALCRCRHR1CRHR2HCRTR1
SCHEMBL30607442	0.84	CALCR (0.63)	F2NMBRGRPRCALCRHCRTR1

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