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Mesotrione

Mesotrione

SCHEMBL20723636

CC(C)N.CS(=O)(=O)c1ccc(C(=O)C2C(=O)CCCC2=O)c([N+](=O)[O-])c1.O=C(O)CNCP(=O)(O)O

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HPD P32754 1/20 0.43
▸ ALDH1A1 P00352 6/20 0.39
▸ ALDH3A1 P30838 3/20 0.35
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ PKM P14618 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
Mesotrione SCHEMBL18115347 0.96 HPD (0.47) HPDALDH1A1ALDH3A1KMT2AMEN1
Mesotrione SCHEMBL20723451 0.95 HPD (0.46) HPDALDH1A1ALDH3A1KMT2AMEN1
Mesotrione SCHEMBL19838155 0.86 HPD (0.57) HPDALDH1A1ALDH3A1KMT2AMEN1
Mesotrione SCHEMBL7588610 0.83 MEN1 (0.43) HPDKMT2AMEN1
Sulcotrione SCHEMBL19464124 0.82 MAPT (0.40) ALDH1A1KMT2AMEN1
Mesotrione SCHEMBL29352201 0.81 HPD (0.62) HPDALDH1A1ALDH3A1KMT2AMEN1
Mesotrione SCHEMBL22116 0.81 HPD (0.62) HPDALDH1A1ALDH3A1KMT2AMEN1
Mesotrione SCHEMBL4895947 0.81 HPD (0.62) HPDALDH1A1ALDH3A1KMT2AMEN1
Mesotrione SCHEMBL7578069 0.80 HPD (0.43) HPD
Mesotrione SCHEMBL19462944 0.80 HPD (0.45) HPDALDH1A1

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-2019030097-A2 HERBICIDAL MIXTURES COMPRISING L-GLUFOSINATE AND THEIR USE IN SOYBEAN CULTURES BASF SE (DE) 2019-02-14 — — WO disclosed