SCHEMBL10098283

SCHEMBL10098283

Cc1ccc(COC23C=C(F)C(O)(CC2)CC3)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGXT P21549 2/20 0.36
TRPA1 O75762 1/20 0.35
TP53 P04637 2/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
MAPT P10636 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
MAOB P27338 1/20 0.31
NAAA Q02083 1/20 0.31
ALDH1A1 P00352 1/20 0.31
OPRM1 P35372 1/20 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
SCHEMBL10098323 0.88 IDO1 (0.35) FFAR4
SCHEMBL10097016 0.85 AGXT (0.38) AGXTTRPA1NPC1RAB9ACA1
SCHEMBL10097054 0.81 AGXT (0.35) AGXTCA1CA2CA9NAAA
SCHEMBL10098273 0.78 IDO1 (0.34) FFAR4
SCHEMBL10098194 0.75 AGXT (0.37) AGXTTRPA1NPC1RAB9ACA1
SCHEMBL10098290 0.67 AGXT (0.38) AGXTTRPA1NPC1RAB9ACA1
SCHEMBL10097094 0.64 AGXT (0.38) AGXTTRPA1NPC1RAB9ACA1
SCHEMBL10098049 0.63 AGXT (0.34) AGXTTRPA1NPC1RAB9ACA1
SCHEMBL10097122 0.62 AGXT (0.36) AGXTCA1CA2CA9MAOB
SCHEMBL10098097 0.62 IDO1 (0.36)

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 AGXT 3784/4885TRPA1 1210/4885TP53 1955/4885

“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.