SCHEMBL8752147

SCHEMBL8752147

CCCCCCCCCCCCC(CCCCCCCCCC)C(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
CA2 P00918 2/20 0.37
CA1 P00915 1/20 0.37
CES2 O00748 3/20 0.36
ZDHHC7 Q9NXF8 1/20 0.36
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 1/20 0.34
PRKCD Q05655 2/20 0.33
CPB2 Q96IY4 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33

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
SCHEMBL8752093 0.99 CA2 (0.40) MAPTCA2CA1CES2ZDHHC7
SCHEMBL8752111 0.90 CA2 (0.49) CA2CA1
SCHEMBL8083858 0.90 CA2 (0.49) CA2CA1
SCHEMBL9854407 0.85 MAPT (0.37) MAPTCA2CA1CES2ZDHHC7
SCHEMBL24603122 0.84 HDAC1 (0.38) CA2CA1HDAC3HDAC4HDAC1
SCHEMBL8576672 0.82 NAAA (0.38) MAPTCES2CES1FAAHNAAA
SCHEMBL8579715 0.82 NAAA (0.38) MAPTCES2CES1FAAHNAAA
SCHEMBL12269799 0.81 CA2 (0.42) MAPTCA2CA1CES2ZDHHC7
SCHEMBL12269856 0.81 CA2 (0.42) MAPTCA2CA1CES2ZDHHC7
SCHEMBL8752032 0.80 DGKA (0.57) MAPTCES2CES1FAAHNAAA

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
EP-0737508-B1 Use of hydrofluorocarbon compound in an emulsion, emulsion and composition containing the same OREAL (FR) 1997-04-16 EP claimed