SCHEMBL24285403

N=C(N)NCCC[C@@H]1NC(=O)[C@@H](CCCCNC(=O)[C@H](N)CS)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)CNC1=O

nearest known ligand 0.53

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	ITGB3	P05106	14/20	0.53

▸	ITGAV	P06756	10/20	0.53

▸	ITGB1	P05556	2/20	0.53

▸	ITGA5	P08648	2/20	0.53

▸	ITGA2B	P08514	4/20	0.51

▸	ITGB5	P18084	6/20	0.51

▸	MC4R	P32245	6/20	0.51

▸	MC5R	P33032	6/20	0.51

▸	MC3R	P41968	6/20	0.51

▸	MC1R	Q01726	6/20	0.51

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
SCHEMBL20754200	1.00	ITGB3 (0.53)	ITGB3ITGAVITGB1ITGA5ITGA2B
SCHEMBL22807688	1.00	ITGB3 (0.53)	ITGB3ITGAVITGB1ITGA5ITGA2B
SCHEMBL22758169	1.00	ITGB3 (0.53)	ITGB3ITGAVITGB1ITGA5ITGA2B
SCHEMBL22807638	0.96	ITGB3 (0.54)	ITGB3ITGAVITGB1ITGA5ITGA2B
SCHEMBL22872747	0.94	ITGB3 (0.51)	ITGB3ITGAVITGB1ITGA5ITGA2B
SCHEMBL7743670	0.90	ITGB3 (0.56)	ITGB3ITGAVITGB1ITGA5ITGA2B
SCHEMBL19981446	0.90	ITGB3 (0.56)	ITGB3ITGAVITGB1ITGA5ITGA2B
SCHEMBL22970321	0.90	ITGB3 (0.56)	ITGB3ITGAVITGB1ITGA5ITGA2B
SCHEMBL7744260	0.90	ITGB3 (0.56)	ITGB3ITGAVITGB1ITGA5ITGA2B
SCHEMBL12496488	0.90	ITGB3 (0.55)	ITGB3ITGAVITGB1ITGA5ITGA2B

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
WO-2022052014-A1	CLASS OF PLATINUM COMPOUNDS FOR TREATING CANCER, AND METHOD FOR PREPARATION THEREOF	上海海聚生物科技有限公司	2022-03-17	—	—	WO	disclosed