SCHEMBL7937043

COc1cccc(CNC[C@@H](O)[C@H](COc2cc(F)cc(F)c2)NC(=O)c2cc(NC[C@H]3C[C@@H]3C)nc(N(C)S(=O)(=O)C(C)C)c2)c1

nearest known ligand 0.57

Predicted protein targets (top 1)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	20/20	0.57

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
SCHEMBL7945934	0.92	BACE1 (0.56)	BACE1
SCHEMBL7946201	0.92	BACE1 (0.56)	BACE1
SCHEMBL7945097	0.92	BACE1 (0.56)	BACE1
SCHEMBL7947060	0.92	BACE1 (0.56)	BACE1
SCHEMBL7944509	0.87	BACE1 (0.57)	BACE1
SCHEMBL7878250	0.87	BACE1 (0.61)	BACE1
SCHEMBL7946022	0.87	BACE1 (0.64)	BACE1
SCHEMBL7943468	0.86	BACE1 (0.55)	BACE1
SCHEMBL7948066	0.85	BACE1 (0.55)	BACE1
SCHEMBL7943531	0.85	BACE1 (0.63)	BACE1

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-2010042030-A1	ASPARTYL PROTEASE INHIBITORS	MEDIVIR AB (SE)	2010-04-15	—	—	WO	disclosed