SCHEMBL2078006

CC(C)(C)N(C(=O)O)[C@@H](Cc1cccc(C#C[Si](C)(C)C)c1)[C@@H](CO)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

	gene	UniProt	supporting neighbours	confidence
▸	PTGES	O14684	12/20	0.33

▸	FOLH1	Q04609	1/20	0.31

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
SCHEMBL2078009	1.00	PTGES (0.33)	PTGESFOLH1
SCHEMBL2079855	0.86	PTGES (0.34)	PTGES
SCHEMBL2079851	0.86	PTGES (0.34)	PTGES
SCHEMBL2176326	0.84	SLC1A1 (0.37)	—
SCHEMBL4344352	0.81	PTGES (0.34)	PTGESFOLH1
SCHEMBL4344357	0.81	PTGES (0.34)	PTGESFOLH1
SCHEMBL1797387	0.76	CYP3A4 (0.44)	—
SCHEMBL2769284	0.72	ALKBH1 (0.33)	—
SCHEMBL4356102	0.71	PTGES (0.34)	PTGES
SCHEMBL2079852	0.71	CYP3A4 (0.35)	PTGES

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-8163909-B2	Substituted hydroxyethyl amine compounds as beta-secretase modulators and methods of use	AMGEN INC. (US)	2012-04-24	—	—	US	disclosed