SCHEMBL6867246

SCHEMBL6867246

O=C(O)C(Cl)(CCCl)Oc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.39
PPARA Q07869 4/20 0.39
CYP1A2 P05177 2/20 0.38
ALOX15 P16050 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C19 P33261 1/20 0.36
RNF4 P78317 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MAPK1 P28482 2/20 0.34
TRPA1 O75762 1/20 0.34
GSK3B P49841 1/20 0.34
HIF1A Q16665 1/20 0.34
SRC P12931 1/20 0.34
PKM P14618 1/20 0.33
MITF O75030 1/20 0.33
POLB P06746 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
SCHEMBL1019373 0.85 CYP1A2 (0.41) PPARGPPARACYP1A2ALOX15MEN1
SCHEMBL3949484 0.80 PPARG (0.43) PPARGPPARACYP1A2ALOX15MEN1
SCHEMBL10587982 0.79 PPARG (0.46) PPARGPPARAALDH1A1
SCHEMBL28253000 0.79 CHRM3 (0.37) CYP1A2MEN1KMT2ACYP3A4CYP2D6
SCHEMBL11169761 0.77 PPARG (0.55) PPARGPPARACYP1A2MEN1KMT2A
SCHEMBL10886243 0.77 PPARA (0.45) PPARGPPARACYP1A2MEN1KMT2A
Dimethylamine SCHEMBL29195865 0.76 PPARG (0.40) PPARGPPARACYP1A2ALOX15MEN1
SCHEMBL10699675 0.75 PPARA (0.50) PPARGPPARAMEN1KMT2AMAPT
SCHEMBL692135 0.72 CYP1A2 (0.46) PPARGPPARACYP1A2ALOX15MEN1
SCHEMBL28822686 0.72 KCNN4 (0.44) PPARGPPARAALOX15MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108947812-A A kind of purification process of phenoxy carboxylic acid herbicides 山东润博生物科技有限公司 2018-12-07 CN disclosed
US-6825151-B2 HERBICIDE MIXTURE WITH APROTIC SOLVENT NUFARM AMERICAS INC. 2004-11-30 US disclosed
US-20030211943-A1 Liquid herbicidal compositions and use thereof in a granular herbicide NUFARM AMERICAS INC. 2003-11-13 US disclosed