SCHEMBL30495658

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC

nearest known ligand 0.60

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	7/20	0.59

▸	NPY4R	P50391	7/20	0.59

▸	NPY5R	Q15761	7/20	0.59

▸	NPY1R	P25929	5/20	0.59

▸	EP300	Q09472	1/20	0.57

▸	HIF1A	Q16665	1/20	0.57

▸	NMUR2	Q9GZQ4	3/20	0.56

▸	NMUR1	Q9HB89	3/20	0.56

▸	RAMP3	O60896	1/20	0.54

▸	CALCR	P30988	1/20	0.54

▸	F2	P00734	4/20	0.54

▸	TFPI	P10646	1/20	0.53

▸	KEAP1	Q14145	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
SCHEMBL30648455	0.88	EP300 (0.64)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30277956	0.86	EP300 (0.63)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30607435	0.84	NPY2R (0.76)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL29814922	0.84	NPY2R (0.61)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL29649229	0.84	NPY2R (0.67)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30277959	0.83	KEAP1 (0.60)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30262084	0.83	F2 (0.60)	NPY2RNPY4RNPY5RNPY1RF2
SCHEMBL31182641	0.83	MAPK8 (0.63)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL31005063	0.82	NPY2R (0.62)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL29479812	0.82	KEAP1 (0.60)	NPY2RNPY4RNPY5RNPY1REP300

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
US-20230190887-A1	TARGETING G3BP AGGREGATION TO PREVENT NEURODEGENERATION	UNIVERSITY OF SOUTH CAROLINA (US)	2023-06-22	—	—	US	disclosed