SCHEMBL6571680

SCHEMBL6571680

COCCCOC(c1ncccc1S(=O)(=O)NC(=O)Nc1nc(OC)cc(OC)n1)C(C)F

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
CDK1 P06493 1/20 0.41
MAPT P10636 3/20 0.37
TP53 P04637 1/20 0.37
GLA P06280 1/20 0.37
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 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
SCHEMBL6571708 0.93 GAA (0.46) GAACDK1MAPTTP53GLA
SCHEMBL6944985 0.87 GAA (0.46) GAACDK1MAPTTP53GLA
SCHEMBL118237 0.85 GAA (0.47) GAACDK1MAPTTP53GLA
SCHEMBL15427726 0.85 GAA (0.47) GAACDK1MAPTTP53GLA
SCHEMBL8097780 0.85 GAA (0.50) GAACDK1MAPTTP53GLA
SCHEMBL6571681 0.84 GAA (0.48) GAACDK1MAPTTP53GLA
SCHEMBL28422175 0.84 GAA (0.47) GAACDK1MAPTTP53GLA
SCHEMBL14366604 0.84 GAA (0.54) GAACDK1MAPTTP53GLA
SCHEMBL3679455 0.83 GAA (0.53) GAACDK1MAPTTP53GLA
Methoxyacetic Acid SCHEMBL27733351 0.83 GAA (0.44) GAACDK1MAPTTP53GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020060246-A1 CONTROLLED-RELEASE AGROCHEMICAL GRANULES AND PREPARATION METHOD THEREFOR 주식회사 엘지화학 2020-03-26 WO claimed
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 claimed
US-20040116298-A1 HERBICIDALLY ACTIVE PYRIDINE SULFONYL UREA DERIVATIVES LG LIFE SCIENCES 2004-06-17 US claimed
EP-1334099-B1 HERBICIDALLY ACTIVE PYRIDINE SULFONYL UREA DERIVATIVES LG CHEM INVESTMENT LTD (KR) 2004-03-10 EP claimed
WO-2020060246-A1 CONTROLLED-RELEASE AGROCHEMICAL GRANULES AND PREPARATION METHOD THEREFOR 주식회사 엘지화학 2020-03-26 WO disclosed
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-6762305-B2 PRE- AND/OR POST-EMERGENCE TREATMENT IN RICE FARMING LG LIFE SCIENCES (KR) 2004-07-13 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