SCHEMBL168159

SCHEMBL168159

CCOC(=O)Oc1cc(-c2ccccc2)n(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 7/20 0.57
RPA1 P27694 1/20 0.52
GABRA2 P47869 1/20 0.52
GABRB2 P47870 1/20 0.52
SMPD1 P17405 1/20 0.50
LMNA P02545 2/20 0.49
ALOX12 P18054 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
FAAH O00519 1/20 0.49
CNR2 P34972 1/20 0.48
ADORA3 P0DMS8 1/20 0.46
SLC16A3 O15427 1/20 0.45
SLC16A1 P53985 1/20 0.45
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL1110698 0.86 PPP1CA (0.50) RPA1GABRA2GABRB2LMNAFAAH
SCHEMBL6053365 0.85 MARS1 (0.66) MARS1RPA1SMPD1LMNAALOX12
SCHEMBL167398 0.84 SIGMAR1 (0.52) GABRA2GABRB2LMNACNR2KDM4E
SCHEMBL342100 0.83 MARS1 (0.68) MARS1RPA1GABRA2GABRB2SMPD1
SCHEMBL29419099 0.83 MARS1 (0.68) MARS1RPA1GABRA2GABRB2SMPD1
SCHEMBL2444530 0.83 MARS1 (0.42) MARS1RPA1GABRA2GABRB2SMPD1
SCHEMBL168942 0.82 SLC5A1 (0.48) RPA1GABRA2GABRB2LMNACNR2
SCHEMBL25396973 0.81 MARS1 (0.61) MARS1RPA1SMPD1LMNAALOX12
SCHEMBL3429282 0.80 FAAH (0.49) LMNAFAAHSLC16A3SLC16A1KMT2A
SCHEMBL376669 0.80 KDM4E (0.45) GABRA2GABRB2LMNACNR2KDM4E

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 688 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2099751-B1 BIPHENYL-SUBSTITUTED SPIROCYCLIC KETOENOLS BAYER IP GMBH (DE) 2018-05-30 EP claimed
EP-2185563-B1 OXASPIROCYCLIC SPIRO-SUBSTITUTED TETRAMIC AND TETRONIC ACID DERIVATIVES BAYER IP GMBH (DE) 2015-08-19 EP claimed
EP-1943218-B1 ALKOXYALKYL SPIROCYCLIC TETRAMIC ACIDS AND TETRONIC ACIDS BAYER IP GMBH (DE) 2015-05-06 EP claimed
EP-2195290-B1 HALOGEN ALKOXY SPIROCYCLIC TETRAMIC AND TETRONIC ACID DERIVATIVES BAYER IP GMBH (DE) 2015-03-11 EP claimed
EP-1771067-B1 SELECTIVE INSECTICIDES BASED ON SUBSTITUTED, CYCLIC KETO-ENOLS AND SAFENERS BAYER CROPSCIENCE AG (DE) 2014-03-12 EP claimed
EP-1855529-B1 SPIROKETAL-SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2013-12-18 EP claimed
EP-1989162-B1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2013-07-03 EP claimed
EP-1791816-B1 IODINE-PHENYL-SUBSTITUTED CYCLIC CETOENOLS BAYER CROPSCIENCE AG (DE) 2012-08-22 EP claimed
EP-1732930-B1 2,4,6-PHENYLSUBSTITUTED CYCLIC KETOENOLES BAYER CROPSCIENCE AG (DE) 2012-05-02 EP claimed
WO-2011138280-A2 HERBICIDE/SAFENER COMBINATIONS COMPRISING ARYLPYRIDAZINONES AND SAFENER BAYER CROPSCIENCE AG (DE) 2011-11-10 WO claimed
WO-2005048710-A1 2-ETHYL-4,6-DIMETHYL-PHENYL-SUBSTITUTED TETRAMIC ACID DERIVATIVES AS PEST CONTROL AGENTS AND/OR HERBICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-06-02 WO claimed
WO-2005044796-A1 2-HALOGEN-6-ALKYL-PHENYL SUBSTITUTED SPIROCYCLIC TETRAMIC ACID DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-05-19 WO claimed
WO-2005044791-A2 2-HALOGEN-6-ALKYL-PHENYL-SUBSTITUTED TETRAMIC ACID DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-05-19 WO claimed
WO-2004111042-A1 N-HETEROCYCLYL PHENYL-SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-12-23 WO claimed
WO-2004080962-A1 2,4,6-PHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-09-23 WO claimed
WO-2004065366-A1 2.4-DIHALOGEN-6-(C2-C3-ALKYL)-PHENYL SUBSTITUTED TETRAMIC ACID DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-08-05 WO claimed
EP-1429613-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED THIEN-3-YL-SULFONYLAMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES AND SAFENERS Bayer CropScience AG (DE) 2004-06-23 EP claimed
EP-1418811-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED CYCLIC KETO-ENOLS AND SAFENERS Bayer CropScience AG (DE) 2004-05-19 EP claimed
WO-2003026427-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED THIEN-3-YL-SULFONYLAMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES AND SAFENERS BAYER CROPSCIENCE AG (DE) 2003-04-03 WO claimed
WO-2003013249-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED CYCLIC KETO-ENOLS AND SAFENERS BAYER CROPSCIENCE AG (DE) 2003-02-20 WO claimed