SCHEMBL10098010

SCHEMBL10098010

Cc1ccc(/C=C/C23CCC(/C=C/c4ccc(O)c(F)c4F)(CC2)C(F)=C3F)cc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 5/20 0.37
PTGS1 P23219 2/20 0.33
PTGS2 P35354 2/20 0.33
ALOX5 P09917 1/20 0.33
CA1 P00915 1/20 0.32
MAOA P21397 3/20 0.32
MAOB P27338 3/20 0.32
MAPT P10636 2/20 0.31
SLC5A1 P13866 1/20 0.31
SLC5A2 P31639 1/20 0.31
AQP1 P29972 1/20 0.30
RAB9A P51151 2/20 0.30
FGF23 Q9GZV9 1/20 0.30
KMT2A Q03164 1/20 0.30
POLB P06746 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
SCHEMBL10098116 0.87 NFE2L2 (0.32) NFE2L2
SCHEMBL10098119 0.87 NFE2L2 (0.32) NFE2L2
SCHEMBL10097118 0.86 NFE2L2 (0.39) NFE2L2PTGS1PTGS2ALOX5CA1
SCHEMBL10098266 0.84 NFE2L2 (0.35) NFE2L2PTGS1PTGS2ALOX5CA1
SCHEMBL10098341 0.80
SCHEMBL10097999 0.77
SCHEMBL10097051 0.74 NFE2L2 (0.33) NFE2L2
SCHEMBL10097972 0.70 HPGD (0.31)
SCHEMBL10096906 0.70 NFE2L2 (0.37) NFE2L2PTGS1PTGS2ALOX5
SCHEMBL10097092 0.69

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-8124196-B2 Fluorobicyclo[2.2.2]octane compound, method of producing the same, and applications thereof FUJIFILM CORPORATION (JP) 2012-02-28 US disclosed
US-20100231844-A1 FLUOROBICYCLO[2.2.2]OCTANE COMPOUND, METHOD OF PRODUCING THE SAME, AND APPLICATIONS THEREOF FUJIFILM CORPORATION (JP) 2010-09-16 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-20100231844-A1 FLUOROBICYCLO[2.2.2]OCTANE COMPOUND, METHOD OF PRODUCING THE SAME, AND APPLICATIONS THEREOF AFF2, FPR2, SLCO1A2 NFE2L2 636/4885PTGS1 4475/4885PTGS2 2168/4885

“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.