SCHEMBL8934903

SCHEMBL8934903

CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(CC)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
FFAR4 Q5NUL3 1/20 0.31
OPRL1 P41146 3/20 0.31
CHKA P35790 1/20 0.31
MAPK1 P28482 1/20 0.30
ALOX5AP P20292 2/20 0.30
FEN1 P39748 2/20 0.30
CYP1A2 P05177 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 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
SCHEMBL8934994 0.99 MAPT (0.37) MAPTGAAMEN1KMT2AFFAR4
SCHEMBL8961833 0.97 GAA (0.34) MAPTGAAMEN1KMT2A
SCHEMBL8962132 0.96 GAA (0.35) MAPTGAAMEN1KMT2A
SCHEMBL8934922 0.92 GAA (0.35) MAPTGAAMEN1KMT2AFFAR4
SCHEMBL8934910 0.92 GAA (0.35) MAPTGAAMEN1KMT2AFFAR4
SCHEMBL8934918 0.92 MAPT (0.35) MAPTGAAMEN1KMT2AFFAR4
SCHEMBL8934862 0.91 CYP2C9 (0.36) MAPTMEN1KMT2AFFAR4OPRL1
SCHEMBL17614839 0.91 MAPT (0.38) MAPTGAAMEN1KMT2AOPRL1
SCHEMBL8935026 0.91 MAPT (0.36) MAPTGAAMEN1KMT2A
SCHEMBL8935012 0.91 MAPT (0.36) MAPTGAAMEN1KMT2A

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
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed