SCHEMBL6571896

SCHEMBL6571896

COCC(=O)OC(c1ncccc1S(=O)(=O)NC(C)(C)C)C(C)F

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 6/20 0.33
FEN1 P39748 6/20 0.33
USP30 Q70CQ3 3/20 0.33
POLB P06746 3/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
SLC22A12 Q96S37 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
SCHEMBL8106979 0.86 ALOX5AP (0.35) ALOX5APFEN1USP30POLB
SCHEMBL6571688 0.85 CA2 (0.35) POLBALDH1A1KDM4E
SCHEMBL6819942 0.83 PIK3C3 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL15427726 0.80 GAA (0.47) ALDH1A1KDM4E
SCHEMBL118237 0.80 GAA (0.47) ALDH1A1KDM4E
Methoxyacetic Acid SCHEMBL27733351 0.77 GAA (0.44) ALDH1A1KDM4E
SCHEMBL7806538 0.77 USP30 (0.34) ALOX5APFEN1USP30POLBALDH1A1
SCHEMBL6574265 0.76 ALOX5AP (0.38) ALOX5APFEN1USP30KDM4ESMN1; SMN2
SCHEMBL6816641 0.73 CA1 (0.36) ALDH1A1
SCHEMBL27733349 0.73 GAA (0.42) ALDH1A1KDM4E

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
US-6806229-B1 SULFUR COMPOUNDS SUCH AS N-((4,6-DIMETHOXYPYRIMIDIN-2-YL) AMINOCARBONYL)-2-(2-FLUORO-1-METHOXYACTETOXY-N-PROPYL)PYRIDINE -3-SULFONAMIDE AND ISOMERS, USED AS PRE-AND/OR POST-EMERGENCE HERBICIDES LG LIFE SCIENCES (KR) 2004-10-19 US disclosed
US-20040116298-A1 HERBICIDALLY ACTIVE PYRIDINE SULFONYL UREA DERIVATIVES LG LIFE SCIENCES 2004-06-17 US disclosed
EP-1334099-B1 HERBICIDALLY ACTIVE PYRIDINE SULFONYL UREA DERIVATIVES LG CHEM INVESTMENT LTD (KR) 2004-03-10 EP disclosed
EP-1334099-A4 HERBICIDALLY ACTIVE PYRIDINE SULFONYL UREA DERIVATIVES LG CHEM INVESTMENT LTD (KR) 2003-08-13 EP disclosed
EP-1334099-A1 HERBICIDALLY ACTIVE PYRIDINE SULFONYL UREA DERIVATIVES LG Chem Investment Ltd. (KR) 2003-08-13 EP disclosed
WO-2002030921-A1 HERBICIDALLY ACTIVE PYRIDINE SULFONYL UREA DERIVATIVES LG CHEM INVESTMENT LTD. (KR) 2002-04-18 WO disclosed