Propaquizafop

Propaquizafop

SCHEMBL2317541

CC(C)=NOCCOC(=O)[C@@H](C)Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1.Clc1ccccc1Cl

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
CYP1A2 P05177 3/20 0.57
MAPT P10636 3/20 0.57
CYP3A4 P08684 2/20 0.57
LMNA P02545 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
HPGD P15428 2/20 0.57
NPSR1 Q6W5P4 2/20 0.57
TP53 P04637 1/20 0.57
ALOX15 P16050 1/20 0.57
NFKB1 P19838 1/20 0.57
HIF1A Q16665 1/20 0.57
GMNN O75496 1/20 0.57
APEX1 P27695 1/20 0.57
PMP22 Q01453 1/20 0.57
L3MBTL1 Q9Y468 4/20 0.45
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HTT P42858 9/20 0.41
CYP2C19 P33261 2/20 0.37

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
Propaquizafop SCHEMBL54333 0.96 MAPT (0.61) ALDH1A1CYP1A2MAPTCYP3A4LMNA
Propaquizafop SCHEMBL9136963 0.96 MAPT (0.61) ALDH1A1CYP1A2MAPTCYP3A4LMNA
Propaquizafop SCHEMBL43925 0.96 MAPT (0.61) ALDH1A1CYP1A2MAPTCYP3A4LMNA
Propaquizafop SCHEMBL8540160 0.92 MAPT (0.58) ALDH1A1CYP1A2MAPTCYP3A4LMNA
Propaquizafop SCHEMBL28841958 0.90 MAPT (0.56) ALDH1A1CYP1A2MAPTCYP3A4LMNA
SCHEMBL10959202 0.89 MAPT (0.63) ALDH1A1CYP1A2MAPTCYP3A4LMNA
Propaquizafop SCHEMBL28163652 0.87 MAPT (0.52) ALDH1A1CYP1A2MAPTCYP3A4LMNA
Propaquizafop SCHEMBL9739797 0.87 MAPT (0.49) ALDH1A1CYP1A2MAPTCYP3A4LMNA
Propaquizafop SCHEMBL28163665 0.87 MAPT (0.49) ALDH1A1CYP1A2MAPTCYP3A4LMNA
SCHEMBL10732452 0.87 ALDH1A1 (0.46) ALDH1A1CYP1A2MAPTCYP3A4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011094219-A1 VESICULAR FORMULATIONS KROON HENDRICK-ANDRE (US) 2011-08-04 WO disclosed