SCHEMBL8947357

SCHEMBL8947357

C=CCOc1ccc(-c2ccc(-c3ccc(-c4ccc5cc(CCCCC)cc(F)c5c4F)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.35
LTA4H P09960 1/20 0.33
MPL P40238 3/20 0.33
CNR2 P34972 3/20 0.33
LMNA P02545 1/20 0.32
CNR1 P21554 2/20 0.32
MEN1 O00255 2/20 0.31
ALDH1A1 P00352 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP2D6 P10635 1/20 0.31
HTR2C P28335 3/20 0.31
HTR2B P41595 3/20 0.31
CTSL P07711 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
RARA P10276 1/20 0.31
RARG P13631 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL8947021 0.89 RARB (0.35) RARBLTA4HMPLCNR2LMNA
SCHEMBL8942430 0.89 CNR2 (0.39) RARBLTA4HMPLCNR2LMNA
SCHEMBL8947187 0.86 CTSL (0.36) RARBLTA4HMPLCNR2LMNA
SCHEMBL8946222 0.85 RARB (0.40) RARBLTA4HMPLCNR2LMNA
SCHEMBL8947367 0.85 LTA4H (0.38) RARBLTA4HMPLCNR2LMNA
SCHEMBL8947372 0.82 CTSL (0.33) RARBLTA4HCNR2LMNACNR1
SCHEMBL14526061 0.79 RARB (0.40) RARBMPLRARARARG
SCHEMBL8945787 0.78 RARB (0.39) RARBLTA4HCNR2LMNAMEN1
SCHEMBL8947153 0.78 CTSL (0.35) LTA4HCNR2LMNACNR1MEN1
SCHEMBL8942564 0.78 RAB9A (0.49) RARBLTA4HCNR2CNR1MEN1

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