SCHEMBL5332304

SCHEMBL5332304

O=C(OC(C(F)(F)F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.34
ABHD6 Q9BV23 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
SCHEMBL5314963 0.86 ABHD6 (0.32) ABHD6
SCHEMBL26101283 0.77 TSHR (0.39) THRB
SCHEMBL10543320 0.77 ABHD6 (0.30) ABHD6
SCHEMBL22767769 0.77 THRB (0.34) THRBABHD6
SCHEMBL5312660 0.75 ABHD6 (0.33) ABHD6
SCHEMBL24901028 0.74 ABHD6 (0.34) ABHD6
SCHEMBL10543184 0.73 ABHD6 (0.35) ABHD6
SCHEMBL346171 0.72 THRB (0.42) THRB
SCHEMBL207310 0.72 THRB (0.42) THRB
SCHEMBL4378631 0.71 PRKCA (0.41) ABHD6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1786822-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS GLAXO GROUP LIMITED (GB) 2007-05-23 EP disclosed
WO-2007016216-A2 USE OF FLUORINATED ESTERS IN FIRE EXTINGUISHING COMPOSITIONS ANSUL, INC. (US) 2007-02-08 WO disclosed
US-20070023740-A1 Use of fluorinated esters in fire extinguishing compositions ANSUL, INC. 2007-02-01 US disclosed
WO-2006024517-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS GLAXO GROUP LIMITED (GB) 2006-03-09 WO disclosed