SCHEMBL31405172

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

nearest known ligand 0.60

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	MC4R	P32245	1/20	0.60

▸	F2	P00734	4/20	0.57

▸	NPY2R	P49146	7/20	0.55

▸	NPY4R	P50391	7/20	0.55

▸	NPY5R	Q15761	7/20	0.55

▸	NPY1R	P25929	5/20	0.55

▸	EP300	Q09472	1/20	0.55

▸	HIF1A	Q16665	1/20	0.55

▸	KDM1A	O60341	2/20	0.54

▸	CALCR	P30988	3/20	0.53

▸	MAOB	P27338	1/20	0.53

▸	KDM5A	P29375	1/20	0.53

▸	KDM1B	Q8NB78	1/20	0.53

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
SCHEMBL30432514	0.92	F2 (0.66)	MC4RF2NPY2RNPY4RNPY5R
Talfirastide SCHEMBL15926158	0.91	AGTR1 (0.59)	MC4RF2CALCR
SCHEMBL31332156	0.89	AGTR2 (0.64)	F2NPY1RCALCR
SCHEMBL31182495	0.88	NPY2R (0.70)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL29602954	0.88	C5AR1 (0.55)	—
SCHEMBL9510693	0.88	AGTR1 (0.60)	MC4RF2NPY2RNPY4RNPY5R
SCHEMBL31544391	0.88	AGTR1 (0.62)	F2CALCR
SCHEMBL29701258	0.88	AGTR2 (0.55)	MC4RF2CALCR
SCHEMBL30901127	0.87	C5AR1 (0.52)	MC4RF2
SCHEMBL29359023	0.86	AGTR2 (0.66)	F2CALCR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-2807191-B2	METHODS OF TREATING PAIN BY INHIBITION OF VGF ACTIVITY	IMPERIAL COLLEGE INNOVATIONS LTD (GB)	2025-01-15	—	—	EP	disclosed