Propaquizafop

Propaquizafop

SCHEMBL9706927

CC(C)=NOC(C)C(C)(Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1)C(=O)O.CC(C)=NOCCOC(=O)[C@@H](C)Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1.CCC(=O)Nc1ccc(Cl)c(Cl)c1.CCC(=O)Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
MAPT P10636 3/20 0.41
CYP3A4 P08684 3/20 0.41
CYP1A2 P05177 2/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
NFKB1 P19838 1/20 0.41
HIF1A Q16665 1/20 0.41
GMNN O75496 1/20 0.41
HPGD P15428 1/20 0.41
APEX1 P27695 1/20 0.41
PMP22 Q01453 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTT P42858 3/20 0.33
GLA P06280 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
Propaquizafop SCHEMBL9739797 0.91 MAPT (0.49) LMNAMAPTCYP3A4CYP1A2ALDH1A1
Propaquizafop SCHEMBL28163665 0.91 MAPT (0.49) LMNAMAPTCYP3A4CYP1A2ALDH1A1
Propaquizafop SCHEMBL54333 0.80 MAPT (0.61) LMNAMAPTCYP3A4CYP1A2ALDH1A1
SCHEMBL6901063 0.80 CYP1A2 (0.52) LMNAMAPTCYP3A4CYP1A2ALDH1A1
Propaquizafop SCHEMBL43925 0.80 MAPT (0.61) LMNAMAPTCYP3A4CYP1A2ALDH1A1
Propaquizafop SCHEMBL9136963 0.80 MAPT (0.61) LMNAMAPTCYP3A4CYP1A2ALDH1A1
Propaquizafop SCHEMBL2317541 0.79 ALDH1A1 (0.57) LMNAMAPTCYP3A4CYP1A2ALDH1A1
Propaquizafop SCHEMBL8540160 0.79 MAPT (0.58) LMNAMAPTCYP3A4CYP1A2ALDH1A1
Propaquizafop SCHEMBL28841958 0.75 MAPT (0.56) LMNAMAPTCYP3A4CYP1A2ALDH1A1
Propaquizafop SCHEMBL28163652 0.74 MAPT (0.52) LMNAMAPTCYP3A4CYP1A2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992010501-A1 HERBICIDAL ETHERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-06-25 WO disclosed
WO-1992009578-A1 SUBSTITUTED FUSED HETEROCYCLIC HERBICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-06-11 WO disclosed