SCHEMBL1128032

SCHEMBL1128032

Cn1cc(OC(=O)Nc2ccccc2-c2ccc(SC(F)(F)F)cc2)c(C(F)F)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 12/20 0.36
NPC1 O15118 2/20 0.35
KCNK2 O95069 1/20 0.35
KCNK10 P57789 1/20 0.35
LMNA P02545 3/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KIF11 P52732 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PLA2G1B P04054 1/20 0.33
THRB P10828 1/20 0.33
NPY1R P25929 1/20 0.33
NPY2R P49146 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33

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
SCHEMBL4794346 0.90 RXFP1 (0.37) CHRM3LMNAALDH1A1KDM4EMAPT
SCHEMBL4803180 0.90 CHRM3 (0.36) CHRM3LMNAALDH1A1KDM4EMAPT
SCHEMBL4850213 0.88 CHRM3 (0.47) CHRM3NPC1ALDH1A1KMT2A
SCHEMBL3034001 0.87 CHRM3 (0.39) CHRM3NPC1KCNK2KCNK10LMNA
SCHEMBL29971 0.84 NTRK1 (0.44) KCNK2KCNK10LMNAALDH1A1KDM4E
SCHEMBL4838355 0.83 TACR1 (0.43) CHRM3NPC1ALDH1A1
SCHEMBL4835379 0.82 CHRM3 (0.47) CHRM3
SCHEMBL4648738 0.82 LMNA (0.40) CHRM3NPC1LMNAMAPTSMN1; SMN2
SCHEMBL4685515 0.81 CHRM3 (0.49) CHRM3NPC1ALDH1A1MAPTTHRB
SCHEMBL5179370 0.81 CHRM3 (0.48) CHRM3MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3057418-B1 INSECTICIDAL ACTIVE MIXTURES COMPRISING CARBOXAMIDE COMPOUND BASF AGROCHEMICAL PRODUCTS BV (NL) 2020-08-26 EP claimed
EP-3383183-B1 COMPOSITIONS CONTAINING CIS-JASMONE AND BACILLUS AMYLOLIQUEFACIENS BASF SE (DE) 2020-05-27 EP claimed
EP-2427062-B1 A METHOD FOR INCREASING THE CROP YIELD OF AGRICULTURAL PLANTS UNDER ESSENTIALLY NON-EXISTENT PATHOGEN PRESSURE BAYER CROPSCIENCE LP (US) 2019-01-16 EP claimed
EP-2978308-B1 EMULSIFIABLE CONCENTRATE COMPRISING PESTICIDE, ALKYL LACTATE, FATTY ACID DIALKYLAMIDE AND DIESTER BASF SE (DE) 2018-05-16 EP claimed
EP-2815650-B1 Fungicidal mixtures II comprising strobilurin-type fungicides BASF SE (DE) 2016-08-17 EP claimed
WO-2008053044-A2 HETARYL CARBON ACID-N-(BIPHEN-2-YL)AMIDE COMPOUNDS BASF SE (DE) 2008-05-08 WO claimed
EP-2259675-B1 FUNGICIDAL COMPOSITIONS COMPRISING 3'-BROMINE-2,3,4,6'-TETRAMETHOXY-2'-6-DIMETHYLBENZOPHENONE BASF SE (DE) 2015-10-07 EP disclosed
EP-2309847-A2 OIL-IN-WATER EMULSION COMPRISING SOLVENT, WATER, SURFACTANT AND PESTICIDE BASF SE (DE) 2011-04-20 EP disclosed
EP-2296465-A2 CALCIUM SALTS OF PHOSPHOROUS ACID FOR INCREASING THE EFFECT OF FUNGICIDES BASF SE (DE) 2011-03-23 EP disclosed
EP-2282633-A1 PROCESS FOR THE PRODUCTION OF PARTICLES COMPRISING ACTIVE AGROCHEMICAL INGREDIENTS IN AMORPHOUS FORM BASF SE (DE) 2011-02-16 EP disclosed
EP-2259675-A2 FUNGICIDAL COMPOSITIONS COMPRISING 3'-BROMINE-2,3,4,6'-TETRAMETHOXY-2'-6-DIMETHYLBENZOPHENONE BASF SE (DE) 2010-12-15 EP disclosed
EP-2235005-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2010-10-06 EP disclosed
EP-2234488-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2010-10-06 EP disclosed
WO-2009103813-A2 FUNGICIDAL COMPOSITIONS COMPRISING 3'-BROMINE-2,3,4,6'-TETRAMETHOXY-2'-6-DIMETHYLBENZOPHENONE BASF SE (DE) 2009-08-27 WO disclosed
WO-2009077500-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2009-06-25 WO disclosed
WO-2009077471-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2009-06-25 WO disclosed
WO-2009077497-A2 AZOLYL METHYL OXIRANES, THE USE THEREOF, AND AGENTS CONTAINING THEM BASF SE (DE) 2009-06-25 WO disclosed
WO-2009077443-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2009-06-25 WO disclosed
WO-2008132179-A2 ACTIVE INGREDIENT COMPOSITIONS FOR PLANT PROTECTION BASF SE (DE) 2008-11-06 WO disclosed
WO-2008132067-A2 ENZYMATIC METHOD FOR THE PRODUCTION OF MICROCAPSULES BASF SE (DE) 2008-11-06 WO disclosed