SCHEMBL470526

CC(C)c1noc(N2CC[C@@H](COc3cnc(N4C[C@H](NC(=O)OC(C)(C)C)[C@@H](c5cc(F)c(F)cc5F)C4)nc3)[C@@H](F)C2)n1

nearest known ligand 0.39

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	GPR119	Q8TDV5	15/20	0.39

▸	KCNH2	Q12809	3/20	0.39

▸	GPR183	P32249	1/20	0.36

▸	LRRK2	Q5S007	2/20	0.31

▸	CYP3A4	P08684	1/20	0.31

▸	CYP2C19	P33261	1/20	0.31

▸	NR1H2	P55055	1/20	0.30

▸	ACACB	O00763	1/20	0.30

▸	RET	P07949	1/20	0.30

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
SCHEMBL12064712	0.95	GPR119 (0.40)	GPR119KCNH2GPR183CYP3A4CYP2C19
SCHEMBL12064741	0.93	GPR119 (0.38)	GPR119KCNH2GPR183RET
SCHEMBL12064792	0.91	GPR119 (0.45)	GPR119KCNH2GPR183ACACB
SCHEMBL12064785	0.89	GPR119 (0.39)	GPR119KCNH2GPR183CYP3A4CYP2C19
SCHEMBL149140	0.87	GPR119 (0.38)	GPR119KCNH2GPR183CYP3A4CYP2C19
SCHEMBL149141	0.87	GPR119 (0.38)	GPR119KCNH2GPR183CYP3A4CYP2C19
SCHEMBL12064799	0.84	GPR119 (0.42)	GPR119KCNH2GPR183
SCHEMBL14730167	0.82	GPR119 (0.37)	GPR119KCNH2GPR183CYP3A4CYP2C19
SCHEMBL14730168	0.82	GPR119 (0.36)	GPR119KCNH2GPR183CYP3A4CYP2C19
SCHEMBL470475	0.81	GPR119 (0.38)	GPR119KCNH2GPR183ACACB

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-2011147951-A1	CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS	PROSIDION LIMITED (GB)	2011-12-01	—	—	WO	disclosed