Malathion

Malathion

SCHEMBL9253814

CCOC(=O)CC(SP(=S)(OC)OC)C(=O)OCC.OP(O)(O)=S

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

Ace1

The experimentally established mechanism targets of Malathion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.94
CYP3A4 P08684 2/20 0.94
ALOX15 P16050 2/20 0.94
HSD17B10 Q99714 2/20 0.94
CHRM1 P11229 1/20 0.94
ADORA1 P30542 1/20 0.94
TSHR P16473 3/20 0.66
TDP1 Q9NUW8 1/20 0.66
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 1/20 0.32
TRPA1 O75762 1/20 0.32
CYP2D6 P10635 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
Malathion SCHEMBL3705116 0.97 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1
Malathion SCHEMBL124812 0.97 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1
Malathion SCHEMBL27358 0.97 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1
Malathion SCHEMBL21693725 0.95 ALDH1A1 (0.97) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1
Malathion SCHEMBL4749884 0.94 ALDH1A1 (0.94) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1
Malathion SCHEMBL6737957 0.94 ALDH1A1 (0.94) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1
Malathion SCHEMBL7092080 0.91 ALDH1A1 (0.89) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1
SCHEMBL5134717 0.91 ALDH1A1 (0.88) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1
SCHEMBL1691874 0.89 ALDH1A1 (0.85) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1
SCHEMBL1692227 0.89 ALDH1A1 (0.85) ALDH1A1CYP3A4ALOX15HSD17B10CHRM1

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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5474998-A Pesticides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-12-12 US disclosed
WO-1994025440-A1 ARTHROPODICIDAL AND NEMATOCIDAL HETEROCYCLIC SULPHONATES DUNLENA PTY. LIMITED (AU) 1994-11-10 WO disclosed
EP-0577712-A1 FUNGICIDAL 4-THIOXOOXAZOLIDIN-2-ONES AND 4-IMINOOXAZOLINDIN-2-ONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-01-12 EP disclosed
EP-0565574-A1 ARTHROPODICIDAL CARBOXANILIDES. DU PONT (US) 1993-10-20 EP disclosed
EP-0561961-A1 NOVEL HETEROCYCLIC AMIDINES AND GUANIDINES AS PLANT FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-09-29 EP disclosed
EP-0555388-A1 INSECTICIDAL, ACARICIDAL AND FUNGICIDAL AMINOPYRIMIDINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-08-18 EP disclosed
EP-0533734-A1 FUNGICIDAL IMINOOXAZOLIDINONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-03-31 EP disclosed
WO-1993005024-A1 ARTHROPODICIDAL ANILIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-03-18 WO disclosed
EP-0530264-A1 ARTHROPODICIDAL TETRAHYDROPYRIDAZINES. DU PONT (US) 1993-03-10 EP disclosed
EP-0515525-A1 ARTHROPODICIDAL TRICHLOROMETHYLBENZYLAMINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-12-02 EP disclosed
WO-1987006430-A1 FUNGICIDAL TRIAZOLES AND IMIDAZOLES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-11-05 WO disclosed
EP-0097464-B1 INSECTICIDAL COMPOSITIONS HAVING HIGH CONCENTRATION OF ACTIVE INGREDIENTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-04-22 EP disclosed
EP-0146610-A4 SUBSTITUTED BENZOPENTATHIEPINS, PROCESS THEREFOR AND INTERMEDIATES. DU PONT (US) 1986-02-20 EP disclosed
EP-0148026-A2 Fungicidal imidazoles and triazoles E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-07-10 EP disclosed
EP-0146610-A1 SUBSTITUTED BENZOPENTATHIEPINS, PROCESS THEREFOR AND INTERMEDIATES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-07-03 EP disclosed
WO-1985001732-A1 8-SUBSTITUTED PYRAZOLOPENTATHIEPINS AND RELATED COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-04-25 WO disclosed
EP-0137717-A2 Fungicidal triazole and imidazole compounds E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-04-17 EP disclosed
EP-0137718-A2 Fungicidal triazoleethanols E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-04-17 EP disclosed
WO-1984004921-A1 SUBSTITUTED BENZOPENTATHIEPINS, PROCESS THEREFOR AND INTERMEDIATES DU PONT (US) 1984-12-20 WO disclosed
EP-0047648-A2 Slow release pesticide formulation E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-03-17 EP disclosed