SCHEMBL272118

SCHEMBL272118

COC(=O)c1nccnc1N(CC(F)F)S(=O)(=O)Cc1ccccc1Br

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
ABL1 P00519 1/20 0.33
SRC P12931 1/20 0.33
HSP90AA1 P07900 1/20 0.32
HSP90B1 P14625 1/20 0.32
ALDH1A1 P00352 4/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ACLY P53396 1/20 0.31
TSHR P16473 2/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
MMP2 P08253 2/20 0.31
MMP9 P14780 2/20 0.31
MMP8 P22894 2/20 0.31
MMP13 P45452 2/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 2/20 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
SCHEMBL271663 0.89 KEAP1 (0.34) KEAP1NFE2L2L3MBTL1MMP9MMP13
SCHEMBL272027 0.88 KEAP1 (0.35) KEAP1NFE2L2ALDH1A1L3MBTL1ACLY
SCHEMBL270665 0.86 BMP1 (0.38) KEAP1NFE2L2ABL1SRCHSP90AA1
SCHEMBL271426 0.86 FFAR4 (0.36) KEAP1NFE2L2L3MBTL1SCD
SCHEMBL271853 0.85 ADAMTS4 (0.35) KEAP1NFE2L2ALDH1A1TSHRMMP13
SCHEMBL271627 0.85 MMP1 (0.39) POLBMMP2MMP9MMP8MMP13
SCHEMBL271653 0.85 MAPT (0.33) POLBGAAMMP2MMP9MMP13
SCHEMBL272058 0.85 TRPM8 (0.37) KEAP1NFE2L2
SCHEMBL271720 0.84 SCD (0.35) KEAP1NFE2L2ALDH1A1POLBKDM4E
SCHEMBL270767 0.81 NOTUM (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2220056-B1 HERBICIDAL COMPOUNDS SYNGENTA LTD (GB) 2015-09-30 EP disclosed
US-8133849-B2 Herbicidal compounds SYNGENTA LIMITED (GB) 2012-03-13 US disclosed
US-20100323889-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-12-23 US disclosed
EP-2220056-A1 HERBICIDAL COMPOUNDS Syngenta Limited (GB) 2010-08-25 EP disclosed
WO-2009063180-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-05-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100323889-A1 HERBICIDAL COMPOUNDS CBR3, DDT, CBR1 KEAP1 34/4885NFE2L2 715/4885ABL1 254/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.