SCHEMBL9546008

SCHEMBL9546008

C=C(CC(F)(F)F)C(=O)OCC(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.45
TET2 Q6N021 1/20 0.31
FABP7 O15540 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
Methacrylic Acid SCHEMBL29219328 0.89 HTT (0.37) HTTTET2
SCHEMBL9546098 0.86 TET2 (0.32) HTTTET2
SCHEMBL9546019 0.83 ALDH1A1 (0.37) HTT
SCHEMBL23979702 0.83 HTT (0.45) HTTFABP7
SCHEMBL10204704 0.83 HTT (0.45) HTTFABP7
SCHEMBL9546127 0.81 ALDH1A1 (0.44)
SCHEMBL906347 0.81 HTT (0.43) HTT
SCHEMBL6865188 0.80 HTT (0.40) HTTTET2
SCHEMBL9696623 0.80 HTT (0.32) HTT
SCHEMBL906210 0.79 TET2 (0.33) TET2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993023773-A1 PROCESS FOR PREPARATION OF OXYGEN PERMEABLE POLYMER MATERIAL CIBA-GEIGY AG (CH) 1993-11-25 WO disclosed
US-5235013-A Copolymerizing an alkene of 6-10 carbons having one double bond and a side chain methyl group and an acrylic or fluoroacrylic ester CIBA-GEIGY CORPORATION 1993-08-10 US disclosed
EP-0478261-A2 Process for producing oxygen-permeable polymer CIBA-GEIGY AG (CH) 1992-04-01 EP disclosed