SCHEMBL845560

SCHEMBL845560

CCCCC(C(=O)O)c1c(C)cccc1C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.43
CYSLTR1 Q9Y271 1/20 0.43
PTGES O14684 5/20 0.41
ALOX5 P09917 5/20 0.41
PPARG P37231 5/20 0.41
PPARA Q07869 5/20 0.41
MAPK1 P28482 2/20 0.40
CA2 P00918 1/20 0.40
CNR2 P34972 1/20 0.40
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.39
ELANE P08246 1/20 0.39
CTRC Q99895 1/20 0.39
HSD17B10 Q99714 1/20 0.38
MME P08473 1/20 0.38

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
SCHEMBL11286814 0.93 CYSLTR2 (0.47) CYSLTR2CYSLTR1PPARGPPARACNR2
SCHEMBL27825247 0.85 CYSLTR2 (0.42) CYSLTR2CYSLTR1MAPK1ALDH1A1MAPT
SCHEMBL10976123 0.81 CNR2 (0.42) CYSLTR2CYSLTR1PTGESALOX5PPARG
SCHEMBL10769700 0.79 CA2 (0.40) PTGESALOX5PPARGPPARAMAPK1
SCHEMBL455432 0.77 POLB (0.53) MAPK1CNR2MEN1ALDH1A1MAPT
SCHEMBL10999525 0.76 PTGES (0.42) CYSLTR2CYSLTR1PTGESALOX5PPARG
SCHEMBL3925301 0.76 PTGES (0.42) CYSLTR2CYSLTR1PTGESALOX5PPARG
SCHEMBL8389560 0.76 PTGES (0.42) CYSLTR2CYSLTR1PTGESALOX5PPARG
SCHEMBL11291328 0.76 CYSLTR2 (0.45) CYSLTR2CYSLTR1PPARGCNR2ALDH1A1
SCHEMBL11295816 0.76 CYSLTR2 (0.45) CYSLTR2CYSLTR1PPARGCNR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103980109-B Process for preparing (2, 4-dimethylbiphenyl-3-yl) acetic acid, esters thereof and intermediate compounds 拜尔农作物科学股份公司 2017-05-03 CN disclosed
CN-103980109-A Process for preparing (2, 4-dimethylbiphenyl-3-yl) acetic acid, esters thereof and intermediate compounds BAYER CROPSCIENCE AG 2014-08-13 CN disclosed
CN-103980109-A Process for preparing (2, 4-dimethylbiphenyl-3-yl) acetic acid, esters thereof and intermediate compounds BAYER CROPSCIENCE AG 2014-08-13 CN disclosed
CN-102471215-B Process for preparing (2, 4-dimethylbiphenyl-3-yl) acetic acid, esters thereof and intermediate compounds BAYER CROPSCIENCE AG 2014-06-11 CN disclosed
CN-102471215-B Process for preparing (2, 4-dimethylbiphenyl-3-yl) acetic acid, esters thereof and intermediate compounds BAYER CROPSCIENCE AG 2014-06-11 CN disclosed
CN-102471215-A Process for preparing (2, 4-dimethylbiphenyl-3-yl) acetic acid, esters thereof and intermediate compounds BAYER CROPSCIENCE AG 2012-05-23 CN disclosed
CN-102471215-A Process for preparing (2, 4-dimethylbiphenyl-3-yl) acetic acid, esters thereof and intermediate compounds BAYER CROPSCIENCE AG 2012-05-23 CN disclosed
EP-2451767-A2 METHOD FOR PRODUCING (2,4-DIMETHYLBIPHENYL-3-YL)ACETIC ACIDS, THE ESTERS THEREOF AND INTERMEDIATE COMPOUNDS Bayer CropScience AG (DE) 2012-05-16 EP disclosed
WO-2011003530-A8 METHOD FOR PRODUCING (2,4-DIMETHYLBIPHENYL-3-YL)ACETIC ACIDS, THE ESTERS THEREOF AND INTERMEDIATE COMPOUNDS BAYER CROPSCIENCE AG (DE) 2012-01-12 WO disclosed
WO-2011003530-A3 METHOD FOR PRODUCING (2,4-DIMETHYLBIPHENYL-3-YL)ACETIC ACIDS, THE ESTERS THEREOF AND INTERMEDIATE COMPOUNDS BAYER CROPSCIENCE AG (DE) 2011-03-17 WO disclosed
WO-2011003530-A2 METHOD FOR PRODUCING (2,4-DIMETHYLBIPHENYL-3-YL)ACETIC ACIDS, THE ESTERS THEREOF AND INTERMEDIATE COMPOUNDS BAYER CROPSCIENCE AG (DE) 2011-01-13 WO disclosed