SCHEMBL16008282

SCHEMBL16008282

CCC(c1c(-c2ccc(C(F)(F)F)cc2S(C)(=O)=O)cnn(C)c1=O)S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 9/20 0.39
FEN1 P39748 9/20 0.39
ITGB1 P05556 1/20 0.34
ITGA4 P13612 1/20 0.34
ITGB7 P26010 1/20 0.34
DDR1 Q08345 2/20 0.33
ABCB11 O95342 1/20 0.32
HIF1A Q16665 1/20 0.32
SCN9A Q15858 1/20 0.32
ADRA1A P35348 1/20 0.32
ELANE P08246 1/20 0.32
PTGDR2 Q9Y5Y4 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
SCHEMBL14844537 0.80 ALOX5AP (0.44) ALOX5APFEN1DDR1HIF1ASCN9A
SCHEMBL29464818 0.80 ALOX5AP (0.44) ALOX5APFEN1DDR1HIF1ASCN9A
SCHEMBL16007810 0.80 ALOX5AP (0.38) ALOX5APFEN1ITGB1ITGA4ITGB7
SCHEMBL16008283 0.78 ALOX5AP (0.40) ALOX5APFEN1DDR1SCN9AADRA1A
SCHEMBL16007991 0.77 ALOX5AP (0.42) ALOX5APFEN1ITGB1ITGA4ITGB7
SCHEMBL14844339 0.76 ALOX5AP (0.43) ALOX5APFEN1DDR1SCN9A
SCHEMBL14844503 0.76 ALOX5AP (0.41) ALOX5APFEN1ITGB1ITGA4ITGB7
SCHEMBL27962367 0.75 ALOX5AP (0.39) ALOX5APFEN1ITGB1ITGA4ITGB7
SCHEMBL16007811 0.75 ALOX5AP (0.41) ALOX5APFEN1ITGB1ITGA4ITGB7
SCHEMBL14844504 0.75 ALOX5AP (0.40) ALOX5APFEN1ITGB1ITGA4ITGB7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9693556-B2 Herbicidal pyridazinone derivatives SYNGENTA LIMITED (GB) 2017-07-04 US disclosed
US-20140256546-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES SYNGENTA LIMITED (GB) 2014-09-11 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-20140256546-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES PRDX6, PRDX1, CBR3 ALOX5AP 2897/4885FEN1 3660/4885ITGB1 3671/4885

“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.