SCHEMBL12683039

CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(-c2ccc3c(=O)c4cc(C5CN=C([C@@H]6CCCN6C(=O)OCc6ccccc6)N5)ccc4oc3c2)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	PRCP	P42785	11/20	0.41

▸	GPR119	Q8TDV5	1/20	0.37

▸	NR1I2	O75469	1/20	0.37

▸	HPGDS	O60760	2/20	0.36

▸	AADAT	Q8N5Z0	1/20	0.36

▸	KCNH2	Q12809	1/20	0.36

▸	HCRTR1	O43613	1/20	0.35

▸	HCRTR2	O43614	1/20	0.35

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
SCHEMBL13161712	0.93	NR1I2 (0.41)	PRCPNR1I2HPGDSKCNH2HCRTR1
SCHEMBL12683181	0.91	PRCP (0.36)	PRCPGPR119HPGDSAADATHCRTR1
SCHEMBL10170973	0.90	PRCP (0.48)	PRCPGPR119NR1I2HPGDSKCNH2
SCHEMBL12682920	0.90	PRCP (0.35)	PRCPNR1I2AADATKCNH2
SCHEMBL10170989	0.84	PRCP (0.45)	PRCPGPR119NR1I2HPGDSKCNH2
SCHEMBL12682904	0.82	AADAT (0.41)	AADAT
SCHEMBL15372079	0.82	NR1I2 (0.47)	PRCPNR1I2HPGDSKCNH2HCRTR1
SCHEMBL10170870	0.82	NR1I2 (0.47)	PRCPNR1I2HPGDSKCNH2HCRTR1
SCHEMBL10213444	0.82	NR1I2 (0.47)	PRCPNR1I2HPGDSKCNH2HCRTR1
SCHEMBL10217757	0.81	PRCP (0.42)	PRCPNR1I2AADATKCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-2012050918-A2	TRICYCLIC FUSED RING INHIBITORS OF HEPATITIS C	PRESIDIO PHARMACEUTICAL, INC. (US)	2012-04-19	—	—	WO	disclosed
WO-2010111534-A1	FUSED RING INHIBITORS OF HEPATITIS C	PRESIDIO PHARMACEUTICALS, INC. (US)	2010-09-30	—	—	WO	disclosed