SCHEMBL496922

SCHEMBL496922

COC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(C)(F)F

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.37
THRB P10828 1/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL25496806 1.00 DGAT1 (0.37) DGAT1THRBHDAC1HDAC7HDAC8
SCHEMBL9501362 0.91 DGAT1 (0.39) DGAT1ALDH1A1
SCHEMBL11205420 0.91 THRB (0.40) DGAT1THRBHDAC1HDAC7HDAC8
SCHEMBL517251 0.91 THRB (0.40) DGAT1THRBHDAC1HDAC7HDAC8
SCHEMBL672362 0.91 THRB (0.40) DGAT1THRBHDAC1HDAC7HDAC8
SCHEMBL3082673 0.91 THRB (0.40) DGAT1THRBHDAC1HDAC7HDAC8
SCHEMBL497763 0.88 DGAT1 (0.39) DGAT1THRBHDAC1HDAC7HDAC8
SCHEMBL497426 0.84 THRB (0.52) DGAT1THRBHDAC1HDAC7HDAC8
SCHEMBL517150 0.84 THRB (0.52) DGAT1THRBHDAC1HDAC7HDAC8
SCHEMBL516962 0.84 THRB (0.52) DGAT1THRBHDAC1HDAC7HDAC8

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-8106222-B2 Fluorine-containing ether compound FUJIFILM CORPORATION (JP) 2012-01-31 US disclosed
US-20090018350-A1 NOVEL FLUORINE-CONTAINING ETHER COMPOUND FUJIFILM CORPORATION (JP) 2009-01-15 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-20090018350-A1 NOVEL FLUORINE-CONTAINING ETHER COMPOUND AFF4, AFF1, AFF2 DGAT1 605/4885THRB 2210/4885HDAC1 2517/4885

“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.