SCHEMBL29699848

CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	13/20	0.46

▸	CALCR	P30988	13/20	0.46

▸	EPHA2	P29317	1/20	0.44

▸	APLNR	P35414	2/20	0.44

▸	PLK1	P53350	1/20	0.44

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
SCHEMBL30493544	0.91	APLNR (0.48)	RAMP3CALCRAPLNRPLK1
SCHEMBL30781629	0.86	EPHA2 (0.49)	RAMP3CALCREPHA2APLNR
SCHEMBL30781627	0.83	RAMP3 (0.50)	RAMP3CALCREPHA2APLNR
SCHEMBL30296665	0.83	NMUR2 (0.51)	RAMP3CALCREPHA2APLNR
SCHEMBL29545348	0.83	RAMP3 (0.54)	RAMP3CALCRAPLNRPLK1
SCHEMBL30973974	0.83	RAMP3 (0.53)	RAMP3CALCREPHA2
SCHEMBL30368254	0.81	NAA50 (0.51)	RAMP3CALCRAPLNRPLK1
SCHEMBL29568938	0.81	CTSL (0.45)	RAMP3CALCREPHA2APLNR
SCHEMBL31326910	0.81	MC4R (0.52)	RAMP3CALCR
SCHEMBL31174607	0.81	NMUR2 (0.50)	RAMP3CALCRPLK1

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-110204594-B	Protein kinase polypeptide inhibitor	北京博肽未名生物技术有限公司	2022-05-27	—	—	CN	disclosed