SCHEMBL29810268

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

nearest known ligand 0.73

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	8/20	0.69

▸	NPY4R	P50391	8/20	0.69

▸	NPY5R	Q15761	8/20	0.69

▸	NPY1R	P25929	6/20	0.69

▸	CALCR	P30988	7/20	0.66

▸	RAMP3	O60896	3/20	0.64

▸	MAPK8	P45983	1/20	0.63

▸	MAPK9	P45984	1/20	0.63

▸	MAPK10	P53779	1/20	0.63

▸	TFPI	P10646	1/20	0.63

▸	HCRTR1	O43613	1/20	0.62

▸	HCRTR2	O43614	1/20	0.62

▸	EP300	Q09472	1/20	0.62

▸	HIF1A	Q16665	1/20	0.62

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
SCHEMBL31182629	0.95	MAPK8 (0.68)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30906377	0.94	NPY2R (0.71)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29494575	0.94	CALCR (0.76)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30686827	0.94	CALCR (0.76)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30686820	0.94	CALCR (0.76)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31182982	0.93	NPY2R (0.73)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30648458	0.93	NPY2R (0.71)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL8814395	0.93	NPY2R (0.71)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30906497	0.93	NPY2R (0.69)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30658298	0.93	NPY2R (0.71)	NPY2RNPY4RNPY5RNPY1RCALCR

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
CN-115073577-A	Synthetic polypeptide and application thereof	南京市口腔医院	2022-09-20	—	—	CN	disclosed