SCHEMBL2214780

CC(=O)Nc1cccc(-c2ccc(-c3cc4ccnn4c(Nc4ccc(N)cc4)n3)cc2)c1.COc1cccc(-c2ccc(-c3cc4ccnn4c(Nc4ccc(N)cc4)n3)cc2)c1.Nc1ccc(Nc2nc(-c3ccc(-c4cccc([N+](=O)[O-])c4)cc3)cc3ccnn23)cc1.Nc1ccc(Nc2nc(-c3ccc(Br)cc3)cc3ccnn23)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	PLAU	P00749	2/20	0.41

▸	PLG	P00747	1/20	0.41

▸	PLAT	P00750	1/20	0.41

▸	ABCG2	Q9UNQ0	9/20	0.39

▸	BCL2	P10415	1/20	0.39

▸	BRAF	P15056	2/20	0.39

▸	SLC2A1	P11166	1/20	0.38

▸	ABCB1	P08183	1/20	0.38

▸	FYN	P06241	2/20	0.38

▸	PIK3CA	P42336	1/20	0.37

▸	SMN1; SMN2	Q16637	1/20	0.36

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
SCHEMBL2880155	0.83	PLK1 (0.43)	ABCG2BRAFABCB1FYN
SCHEMBL2881795	0.83	PLK1 (0.44)	ABCG2PIK3CA
SCHEMBL2876734	0.81	BCDIN3D (0.42)	PLAUPLGPLATABCG2BRAF
SCHEMBL2881793	0.77	CSNK2A1 (0.46)	PLAUPLGPLATABCB1SMN1; SMN2
SCHEMBL2876730	0.76	PLAU (0.52)	PLAUPLGPLATPIK3CASMN1; SMN2
SCHEMBL2881428	0.76	FYN (0.51)	ABCG2BRAFABCB1FYN
SCHEMBL2213283	0.76	PLG (0.42)	PLAUPLGPLATBCL2ABCB1
SCHEMBL2215485	0.73	PLAU (0.42)	PLAUPLGPLATSLC2A1SMN1; SMN2
SCHEMBL2216413	0.73	CYP17A1 (0.49)	ABCG2BRAFABCB1FYN
SCHEMBL2253893	0.73	PLG (0.44)	PLAUPLGPLATABCG2ABCB1

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
EP-1797096-B1	PYRAZOLOPYRIMIDINES AS INHIBITORS OF PROTEIN KINASE B (AKT)	BAYER SCHERING PHARMA AG (DE)	2011-07-27	—	—	EP	disclosed