SCHEMBL3659474

SCHEMBL3659474

Fc1ccc(/C(=C/c2ccccc2C(F)(F)F)CCl)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.38
NFKB1 P19838 1/20 0.36
NFE2L2 Q16236 2/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
PTGES2 Q9H7Z7 2/20 0.34
GRIN2D O15399 2/20 0.34
GRIN3B O60391 2/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2A Q12879 2/20 0.34
GRIN2B Q13224 2/20 0.34
GRIN2C Q14957 2/20 0.34
GRIN3A Q8TCU5 2/20 0.34
CHRM5 P08912 1/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BACE1 P56817 1/20 0.32
NR3C2 P08235 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
SCHEMBL3767448 1.00 MAOB (0.38) MAOBNFKB1NFE2L2CES2CES1
SCHEMBL3782287 0.85 NFE2L2 (0.47) NFE2L2CES2CES1NR3C2
SCHEMBL3782296 0.85 NFE2L2 (0.47) NFE2L2CES2CES1NR3C2
SCHEMBL3776287 0.82 NFE2L2 (0.38) NFE2L2CES2CES1SMN1; SMN2NR3C2
SCHEMBL3662395 0.82 NFE2L2 (0.38) NFE2L2CES2CES1SMN1; SMN2NR3C2
SCHEMBL3664844 0.77 MAOB (0.41) MAOBNFKB1NFE2L2CES2CES1
SCHEMBL3664843 0.77 MAOB (0.41) MAOBNFKB1NFE2L2CES2CES1
SCHEMBL3662353 0.74 NFE2L2 (0.41) NFE2L2SMN1; SMN2
SCHEMBL3769663 0.74 NFE2L2 (0.41) NFE2L2SMN1; SMN2
SCHEMBL3768892 0.73 NFE2L2 (0.47) NFE2L2CES2CES1

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
US-20100317515-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same BASF SE (DE) 2010-12-16 US disclosed
EP-2234488-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2010-10-06 EP disclosed
WO-2009077443-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2009-06-25 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-20100317515-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same XDH, NOX5, TET1 MAOB 53/4885NFKB1 1131/4885NFE2L2 825/4885

“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.