SCHEMBL497470

SCHEMBL497470

CCC(F)(F)C(F)(F)C(F)(F)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.48
ACLY P53396 2/20 0.38
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
FFAR3 O14843 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
Ammonia Solution, Strong SCHEMBL17652258 0.98 THRB (0.46) THRBACLYMEN1ALDH1A1CYP1A2
SCHEMBL31347666 0.93 THRB (0.52) THRBACLYMEN1ALDH1A1CYP1A2
SCHEMBL8811525 0.91 THRB (0.56) THRBACLY
SCHEMBL28359793 0.91 THRB (0.56) THRBACLY
SCHEMBL23829806 0.84 ACLY (0.41) THRBACLYMEN1ALDH1A1CYP1A2
SCHEMBL866752 0.80
Alcohol SCHEMBL10321471 0.77 THRB (0.64) THRBACLYALDH1A1FFAR3
SCHEMBL8573991 0.76 CES2 (0.46) THRBMEN1CYP1A2KMT2A
SCHEMBL1949823 0.75
SCHEMBL712763 0.74 THRB (0.77) THRBACLYALDH1A1

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 THRB 2210/4885ACLY 4750/4885MEN1 1829/4885

“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.