SCHEMBL7864594

SCHEMBL7864594

COc1cnc(OC)n2nc(NS(=O)(=O)c3c(OCCCl)cccc3C(F)(F)F)nc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 3/20 0.37
CCR4 P51679 1/20 0.35
EGFR P00533 3/20 0.33
LRRK2 Q5S007 2/20 0.33
MAPK10 P53779 1/20 0.33
SCN9A Q15858 1/20 0.33
PTK2 Q05397 2/20 0.33
TSHR P16473 3/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 2/20 0.33
ALOX15 P16050 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 0.33
P2RX7 Q99572 2/20 0.33
CYP2C9 P11712 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32

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
SCHEMBL7864634 0.92 SLC22A12 (0.37) SLC22A12CCR4EGFRLRRK2MAPK10
Penoxsulam SCHEMBL116968 0.88 PSEN1 (0.35) SLC22A12CCR4EGFRMAPK10SCN9A
SCHEMBL6630344 0.87 CCR4 (0.37) SLC22A12CCR4LRRK2SCN9ACYP2C9
SCHEMBL7865966 0.87 SLC22A12 (0.34) SLC22A12CCR4EGFRMAPK10SCN9A
Penoxsulam SCHEMBL22587372 0.87 PSEN1 (0.34) SLC22A12CCR4EGFRMAPK10SCN9A
SCHEMBL17864073 0.86 SLC22A12 (0.34) SLC22A12CCR4EGFRMAPK10SCN9A
SCHEMBL7864603 0.85 CCR4 (0.39) SLC22A12CCR4EGFRLRRK2MAPK10
SCHEMBL7859430 0.83 KAT7 (0.38) ALDH1A1
SCHEMBL17864141 0.81 EDNRA (0.34) SLC22A12CCR4EGFRMAPK10SCN9A
SCHEMBL4394420 0.81 SLC22A12 (0.39) SLC22A12CCR4EGFRLRRK2SCN9A

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
EP-0877745-B1 N-( 1,2,4] TRIAZOLOAZINYL)BENZENESULFONAMIDE AND PYRIDINESULFONAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2001-07-25 EP claimed
US-6303814-B1 N-[1,2,4]triazoloazinyl) benzenesulfonamide and pyridinesulfonamide compounds and their use as herbicides DOW AGROSCIENCES LLC 2001-10-16 US disclosed
EP-0877745-B1 N-( 1,2,4] TRIAZOLOAZINYL)BENZENESULFONAMIDE AND PYRIDINESULFONAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2001-07-25 EP disclosed
US-6130335-A N-([1,2,4]triazoloazinyl) benzenesulfonamide and pyridinesulfonamide compounds and their use as herbicides DOW AGROSCIENCES LLC (US) 2000-10-10 US disclosed
US-6005108-A POST-EMERGENCE TOTAL VEGETATION CONTROL OR SELECTIVE CONTROL OF WEEDS IN WHEAT, RICE AND OIL-SEED RAPE CROPS JOHNSON TIMOTHY C (US) 1999-12-21 US disclosed
US-5965490-A NOVEL COMPOUNDS WITH IMPROVED SELECTIVITY TO VALUABLE CROPS AND IMPROVED TOXICOLOGICAL AND ENVIRONMENTAL ATTRIBUTES; APPLYING TO CONTROL WEEDS BY EITHER PREEMERGENCE OR POSTEMERGENCE APPLICATION DOW AGROSCIENCES LLC (US) 1999-10-12 US disclosed