SCHEMBL10097085

SCHEMBL10097085

Cc1ccc(C(=O)OC23CCC(C)(CC2)C(F)=C3F)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.36
HTT P42858 1/20 0.35
CES2 O00748 1/20 0.30
CES1 P23141 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
SCHEMBL10097008 0.77 HPGD (0.40) HPGDL3MBTL1HTT
SCHEMBL10096855 0.72 HPGD (0.40) HPGDL3MBTL1HTT
SCHEMBL10097974 0.71 CES2 (0.31) CES2CES1
SCHEMBL10097088 0.69
SCHEMBL10096800 0.69 HPGD (0.37) HPGDL3MBTL1HTT
SCHEMBL1258800 0.69 HPGD (0.50) HPGDHTTCES2CES1
SCHEMBL10097097 0.69
SCHEMBL7214062 0.68 HPGD (0.49) HPGDL3MBTL1HTTCES2CES1
SCHEMBL10097081 0.68 HPGD (0.32) HPGD
SCHEMBL14941129 0.66 TSHR (0.55) HPGDHTT

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 HPGD 3585/4885L3MBTL1 3789/4885HTT 4207/4885

“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.