SCHEMBL30824286

CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O

nearest known ligand 0.76

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	EP300	Q09472	1/20	0.68

▸	HIF1A	Q16665	1/20	0.68

▸	NPY2R	P49146	8/20	0.67

▸	NPY4R	P50391	8/20	0.67

▸	NPY5R	Q15761	8/20	0.67

▸	NPY1R	P25929	6/20	0.67

▸	CALCR	P30988	5/20	0.65

▸	RAMP3	O60896	3/20	0.65

▸	NMUR2	Q9GZQ4	3/20	0.61

▸	NMUR1	Q9HB89	3/20	0.61

▸	MAPK8	P45983	1/20	0.60

▸	MAPK9	P45984	1/20	0.60

▸	MAPK10	P53779	1/20	0.60

▸	TFPI	P10646	1/20	0.60

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
SCHEMBL30906476	0.93	NPY2R (0.71)	EP300HIF1ANPY2RNPY4RNPY5R
SCHEMBL30607503	0.93	RAMP3 (0.65)	EP300HIF1ANPY2RNPY4RNPY5R
SCHEMBL31603950	0.92	NPY2R (0.68)	EP300HIF1ANPY2RNPY4RNPY5R
SCHEMBL31754009	0.92	MAPK8 (0.65)	EP300HIF1ANPY2RNPY4RNPY5R
SCHEMBL29562124	0.91	NPY2R (0.67)	EP300HIF1ANPY2RNPY4RNPY5R
SCHEMBL30607466	0.91	NPY2R (0.65)	EP300HIF1ANPY2RNPY4RNPY5R
SCHEMBL30432659	0.91	EP300 (0.69)	EP300HIF1ANPY2RNPY4RNPY5R
SCHEMBL31000870	0.90	MAPK8 (0.67)	EP300HIF1ANPY2RNPY4RNPY5R
Savcipsgqpcpyskyccsgsctyktnengnsvqrcd SCHEMBL29838758	0.90	NPY2R (0.69)	EP300HIF1ANPY2RNPY4RNPY5R
SCHEMBL30906497	0.90	NPY2R (0.69)	EP300HIF1ANPY2RNPY4RNPY5R

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-11925667-B2	Engineered therapeutic probiotic system and method	CHANG MATTHEW WOOK (SG)	2024-03-12	—	—	US	disclosed