SCHEMBL30431263

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	9/20	0.64

▸	CALCR	P30988	9/20	0.64

▸	NPY2R	P49146	7/20	0.58

▸	NPY4R	P50391	7/20	0.58

▸	NPY5R	Q15761	7/20	0.58

▸	NPY1R	P25929	5/20	0.58

▸	EP300	Q09472	1/20	0.58

▸	HIF1A	Q16665	1/20	0.58

▸	TFPI	P10646	1/20	0.54

▸	NMUR2	Q9GZQ4	1/20	0.54

▸	NMUR1	Q9HB89	1/20	0.54

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
SCHEMBL31683488	0.92	RAMP3 (0.69)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31683303	0.90	NPY2R (0.66)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29551993	0.89	NPY2R (0.63)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30320529	0.86	KDM1A (0.57)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30432086	0.86	RAMP3 (0.63)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL32670346	0.86	RAMP3 (0.64)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31575684	0.86	KDM1A (0.56)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30432066	0.85	EP300 (0.67)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29939144	0.85	NPY2R (0.58)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL8931244	0.85	NPY2R (0.68)	RAMP3CALCRNPY2RNPY4RNPY5R

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