SCHEMBL693679

SCHEMBL693679

CC(C)(C)OC(=O)N1CCC(C2=C[CH]CC=C2)CC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
KDM4E B2RXH2 2/20 0.50
THRB P10828 1/20 0.50
GPR119 Q8TDV5 7/20 0.45
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44
HPGD P15428 1/20 0.44
NAMPT P43490 1/20 0.43
ALDH1A1 P00352 2/20 0.43
RECQL P46063 1/20 0.42
EPHX1 P07099 1/20 0.42
NPC1 O15118 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PKM P14618 1/20 0.41
KMT2A Q03164 1/20 0.41

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL693163 0.79 MAPT (0.50) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL694033 0.72 MAPT (0.45) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL3436365 0.71 GPR119 (0.58) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL21284377 0.71 THRB (0.50) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL3843148 0.71 NAMPT (0.66) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL4523935 0.70 GPR119 (0.53) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL693162 0.70 NAMPT (0.58) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL12117456 0.70 GPR119 (0.65) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL3854559 0.70 NAMPT (0.61) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL7478208 0.70 GPR119 (0.65) MAPTKDM4ETHRBGPR119NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421824-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP claimed
WO-2010124114-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed
EP-2421824-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP disclosed
WO-2010124114-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed