SCHEMBL272156

SCHEMBL272156

COC(=O)c1nccnc1N(CC(F)F)S(=O)(=O)Cc1ccc(I)cc1Cl

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.30
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL270669 0.93 TSHR (0.32) SCDKEAP1NFE2L2ALDH1A1TSHR
SCHEMBL271710 0.85 ALPL (0.33) ALDH1A1
SCHEMBL271720 0.83 SCD (0.35) SCDKEAP1NFE2L2ALDH1A1
SCHEMBL272027 0.83 KEAP1 (0.35) SCDKEAP1NFE2L2ALDH1A1
SCHEMBL271755 0.82 MAPT (0.41) ALDH1A1
SCHEMBL271937 0.82 POLB (0.37) SCDKEAP1NFE2L2ALDH1A1
SCHEMBL270926 0.81 ALDH1A1 (0.39) SCDALDH1A1TSHR
SCHEMBL271422 0.81 TSHR (0.32) SCDKEAP1NFE2L2ALDH1A1TSHR
SCHEMBL272015 0.80 MRGPRX4 (0.36)
SCHEMBL272118 0.79 KEAP1 (0.35) SCDKEAP1NFE2L2ALDH1A1TSHR

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 3 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

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 SCD 3715/4885KEAP1 34/4885NFE2L2 715/4885

“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.