SCHEMBL7255335

SCHEMBL7255335

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

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.35
GBA1 P04062 4/20 0.34

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
SCHEMBL7258080 0.92 THRB (0.41) THRBGBA1
SCHEMBL4397589 0.85 FAAH (0.44)
SCHEMBL6139936 0.82 THRB (0.34) THRBGBA1
SCHEMBL29628869 0.82 THRB (0.41) THRB
SCHEMBL5150321 0.82 THRB (0.41) THRB
SCHEMBL23788204 0.82 THRB (0.41) THRB
SCHEMBL29628819 0.82 THRB (0.41) THRB
SCHEMBL4612734 0.82 THRB (0.41) THRB
SCHEMBL23788205 0.79 LMNA (0.42) THRB
SCHEMBL13686065 0.77 FAAH (0.34) THRBGBA1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003070714-A1 FLUOROUS ACETYLATION UNISEARCH LIMITED (AU) 2003-08-28 WO disclosed