SCHEMBL30432876

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	APLNR	P35414	2/20	0.55

▸	CALCR	P30988	3/20	0.52

▸	MC4R	P32245	1/20	0.50

▸	CTSL	P07711	2/20	0.49

▸	CTSS	P25774	2/20	0.49

▸	CTSK	P43235	2/20	0.49

▸	F2	P00734	4/20	0.49

▸	CTSH	P09668	1/20	0.49

▸	CRHR1	P34998	1/20	0.48

▸	CRHR2	Q13324	1/20	0.48

▸	GLP1R	P43220	3/20	0.47

▸	GCGR	P47871	3/20	0.47

▸	NMBR	P28336	1/20	0.46

▸	GRPR	P30550	1/20	0.46

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
SCHEMBL29945130	0.85	APLNR (0.67)	APLNRCALCRMC4RCTSLCTSS
SCHEMBL29655893	0.81	APLNR (0.61)	APLNRCALCRF2CRHR1CRHR2
SCHEMBL30906485	0.81	CALCR (0.67)	CALCRCRHR1CRHR2GLP1RGCGR
SCHEMBL30883215	0.81	CRHR1 (0.51)	APLNRCALCRCTSLCTSSCTSK
SCHEMBL29655882	0.80	CALCR (0.60)	APLNRCALCRMC4RCTSLCTSS
SCHEMBL5495351	0.80	NAA50 (0.54)	APLNRCALCRF2
SCHEMBL31031589	0.79	F2 (0.61)	APLNRCALCRMC4RF2CRHR1
SCHEMBL31276246	0.79	F2 (0.54)	APLNRCALCRMC4RF2NMBR
SCHEMBL30608603	0.79	NAA50 (0.51)	APLNRCALCRCRHR1CRHR2
SCHEMBL31182655	0.79	MC4R (0.67)	APLNRMC4RF2GLP1RGCGR

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