SCHEMBL789879

SCHEMBL789879

C=CC(C)(C)C1CC1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 10/20 0.52
GRM3 Q14832 9/20 0.43
GABRR1 P24046 5/20 0.34
GABRR2 P28476 1/20 0.34
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
GRM8 O00222 1/20 0.31
GRM5 P41594 1/20 0.31
GRM1 Q13255 1/20 0.31
GRM7 Q14831 1/20 0.31
GRM4 Q14833 1/20 0.31

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
SCHEMBL10851516 0.78 GRM2 (0.59) GRM2GRM3GABRR1GABRR2
SCHEMBL14365550 0.75 GRM2 (0.61) GRM2GRM3GABRR1GABRR2
SCHEMBL31332625 0.75 GRM2 (0.61) GRM2GRM3GABRR1GABRR2
SCHEMBL23467404 0.71 GRM2 (0.57) GRM2GRM3GABRR1GABRR2
SCHEMBL28486235 0.71 GRM2 (0.57) GRM2GRM3GABRR1GABRR2
SCHEMBL22869500 0.71 GRM2 (0.57) GRM2GRM3GABRR1GABRR2
SCHEMBL28486236 0.71 GRM2 (0.57) GRM2GRM3GABRR1GABRR2
SCHEMBL22869499 0.71 GRM2 (0.57) GRM2GRM3GABRR1GABRR2
SCHEMBL169075 0.71 GRM2 (0.52) GRM2GRM3GABRR1GABRR2MEN1
SCHEMBL31250259 0.68 GRM2 (0.53) GRM2GRM3GABRR1GABRR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2615920-A1 COMPOSITION FOR PEST CONTROL AEROSOL Sumitomo Chemical Company Limited (JP) 2013-07-24 EP disclosed
EP-2552884-A1 PYRETHRINOID - TYPE ESTERS AS PESTICIDES Sumitomo Chemical Company Limited (JP) 2013-02-06 EP disclosed
EP-2552896-A1 ESTER COMPOUND AND USE THEREOF Sumitomo Chemical Company Limited (JP) 2013-02-06 EP disclosed
EP-2552215-A1 ESTER COMPOUND AND USE THEREOF Sumitomo Chemical Company Limited (JP) 2013-02-06 EP disclosed
EP-2539318-A1 ESTER COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2013-01-02 EP disclosed
WO-2012036316-A1 COMPOSITION FOR PEST CONTROL AEROSOL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-22 WO disclosed
WO-2011122505-A1 ESTER COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-06 WO disclosed
WO-2011122509-A1 ESTER COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-06 WO disclosed
WO-2011122508-A1 PYRETHRINOID - TYPE ESTERS AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-06 WO disclosed
WO-2011105526-A1 ESTER COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-09-01 WO disclosed
EP-2265569-A2 NITRILE COMPOUND AND ITS USE FOR CONTROL OF ARTHROPOD PEST Sumitomo Chemical Company, Limited (JP) 2010-12-29 EP disclosed
EP-2183215-A2 IMIDATE COMPOUND AND USE THEREOF FOR PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2010-05-12 EP disclosed
EP-2152668-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD Sumitomo Chemical Company, Limited (JP) 2010-02-17 EP disclosed
WO-2009116687-A2 NITRILE COMPOUND AND ITS USE FOR CONTROL OF ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-09-24 WO disclosed
WO-2009048152-A2 UNSATURATED IMINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-16 WO disclosed
WO-2009014267-A2 IMIDATE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-29 WO disclosed
WO-2008143338-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-11-27 WO disclosed
EP-1679969-A1 PRODUCT AND METHOD FOR CONTROLLING FLYING INSECTS Reckitt Benckiser (Australia) Pty Limited (AU) 2006-07-19 EP disclosed
WO-2005046332-A1 PRODUCT AND METHOD FOR CONTROLLING FLYING INSECTS RECKITT BENCKISER (AUSTRALIA) PTY LIMITED (AU) 2005-05-26 WO disclosed
EP-1439163-A1 PROPARGYLBENZYL ALCOHOL ESTER DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND INSECTICIDE/INSECTIFUGE CONTAINING THE SAME DAINIHON JOCHUGIKU CO., LTD. (JP) 2004-07-21 EP disclosed