SCHEMBL8934918

SCHEMBL8934918

CCCCCc1ccc(-c2ccc(-c3ccc(C4CCC(CCCCC)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
GAA P10253 1/20 0.35
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
RARB P10826 1/20 0.31
CEL P19835 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
ALOX5 P09917 1/20 0.30
TYR P14679 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
OPRL1 P41146 1/20 0.30
CHKA P35790 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
SCHEMBL8935016 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB
SCHEMBL8934962 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB
SCHEMBL8935017 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB
SCHEMBL8935012 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB
SCHEMBL8935026 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB
SCHEMBL8935010 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB
SCHEMBL8934939 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB
SCHEMBL8934930 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB
SCHEMBL8934958 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB
SCHEMBL8934935 0.99 MAPT (0.36) MAPTGAAMEN1KMT2ARARB

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