Metazachlor

Metazachlor

SCHEMBL14719740

Cc1cccc(C)c1N(Cn1cccn1)C(=O)CCl.NC(=O)CCl

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
TP53 P04637 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
CYP3A4 P08684 1/20 0.44
NLRP3 Q96P20 1/20 0.39
NOS3 P29474 1/20 0.36
NOS1 P29475 1/20 0.36
NR1I2 O75469 1/20 0.34
ELANE P08246 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
PAX8 Q06710 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 2/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
GPX4 P36969 1/20 0.34
TSHR P16473 1/20 0.34
THRB P10828 2/20 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
Metazachlor SCHEMBL4896537 0.95 TP53 (0.48) ALDH1A1TP53TDP1CYP3A4NLRP3
Metazachlor SCHEMBL55016 0.95 TP53 (0.48) ALDH1A1TP53TDP1CYP3A4NLRP3
Metazachlor SCHEMBL15109905 0.89 TP53 (0.44) ALDH1A1TP53TDP1CYP3A4NLRP3
SCHEMBL8433228 0.88 TP53 (0.59) ALDH1A1TP53TDP1CYP3A4NLRP3
SCHEMBL10731615 0.86 TP53 (0.46) ALDH1A1TP53TDP1CYP3A4NLRP3
SCHEMBL10736948 0.85 TP53 (0.41) ALDH1A1TP53TDP1CYP3A4NLRP3
SCHEMBL18842880 0.85 NLRP3 (0.43) ALDH1A1TP53TDP1CYP3A4NLRP3
Metazachlor SCHEMBL5575491 0.85 TP53 (0.40) ALDH1A1TP53TDP1CYP3A4NLRP3
Metazachlor SCHEMBL28090839 0.84 KMT2A (0.48) ALDH1A1TP53TDP1CYP3A4NLRP3
Metazachlor SCHEMBL10710848 0.84 THRB (0.41) ALDH1A1TP53TDP1CYP3A4NLRP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2747564-B1 HERBICIDAL COMPOSITIONS COMPRISING CHLOROACETAMIDES BASF SE (DE) 2015-04-01 EP disclosed
EP-2747564-A1 HERBICIDAL COMPOSITIONS COMPRISING CHLOROACETAMIDES BASF SE (DE) 2014-07-02 EP disclosed
EP-2747564-A1 HERBICIDAL COMPOSITIONS COMPRISING CHLOROACETAMIDES BASF SE (DE) 2014-07-02 EP disclosed
CN-103747675-A Herbicidal compositions comprising chloroacetamides BASF SE 2014-04-23 CN disclosed
WO-2013026811-A1 HERBICIDAL COMPOSITIONS COMPRISING CHLOROACETAMIDES BASF SE (DE) 2013-02-28 WO disclosed
WO-2013026811-A1 HERBICIDAL COMPOSITIONS COMPRISING CHLOROACETAMIDES BASF SE (DE) 2013-02-28 WO disclosed