SCHEMBL12331565

COC(C[C@@H](C)[C@H]1CC(=O)[C@@]2(C)C3CC[C@H]4C(C)(C)C(OC5CN(C6COC6)CCO5)CCC45CC35CCC12C)C(OC(C)=O)C(C)(C)O

nearest known ligand 0.49

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	APP	P05067	17/20	0.49

▸	CYP3A4	P08684	10/20	0.49

▸	PSEN1	P49768	1/20	0.40

▸	PSEN2	P49810	1/20	0.40

▸	APH1B	Q8WW43	1/20	0.40

▸	NCSTN	Q92542	1/20	0.40

▸	APH1A	Q96BI3	1/20	0.40

▸	PSENEN	Q9NZ42	1/20	0.40

▸	EPHX2	P34913	1/20	0.38

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
SCHEMBL14755927	0.87	APP (0.55)	APPCYP3A4PSEN1PSEN2APH1B
SCHEMBL14773088	0.86	APP (0.52)	APPCYP3A4PSEN1PSEN2APH1B
SCHEMBL14754570	0.86	APP (0.52)	APPCYP3A4PSEN1PSEN2APH1B
SCHEMBL14755395	0.86	APP (0.41)	APPCYP3A4PSEN1PSEN2APH1B
SCHEMBL14755345	0.85	APP (0.53)	APPCYP3A4PSEN1PSEN2APH1B
SCHEMBL12331124	0.85	APP (0.50)	APPCYP3A4
SCHEMBL14753312	0.84	APP (0.51)	APPCYP3A4
SCHEMBL14755824	0.84	PSEN1 (0.56)	PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12232940	0.83	APP (0.56)	APPCYP3A4
SCHEMBL14755383	0.82	APP (0.55)	APPCYP3A4

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-2011109657-A1	COMPOUNDS USEFUL FOR TREATING NEURODEGENERATIVE DISORDERS	SATORI PHARMACEUTICALS, INC. (US)	2011-09-09	—	—	WO	disclosed