SCHEMBL6661858

SCHEMBL6661858

CCCCCc1ccc(C(F)(F)OC(C)c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
FAAH O00519 1/20 0.40
PLK1 P53350 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
KCNH2 Q12809 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
ALDH1A1 P00352 2/20 0.38
ESR1 P03372 2/20 0.37
ADRA2A P08913 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
TACR2 P21452 2/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL6662955 0.96 HTR2A (0.42) HTR2AFAAHALDH1A1ESR1ADRA2A
SCHEMBL6662750 0.93 HTR2A (0.40) HTR2AFAAHALDH1A1ESR1ADRA2A
SCHEMBL6661968 0.93 HTR2A (0.40) HTR2AFAAHALDH1A1ESR1ADRA2A
SCHEMBL6666975 0.92 FAAH (0.43) HTR2AFAAHALDH1A1ESR1ADRA2A
SCHEMBL6663070 0.91 HTR2A (0.39) HTR2AKMT2AFAAHALDH1A1ESR1
SCHEMBL6660765 0.90 MEN1 (0.42) MEN1KMT2AKCNH2TMEM97TAAR1
SCHEMBL6663838 0.87 PDE2A (0.39) HTR2AMEN1KMT2AFAAHHDAC1
SCHEMBL6662969 0.86 FAAH (0.41) HTR2AMEN1KMT2AFAAHHDAC1
SCHEMBL6667590 0.86 FAAH (0.41) HTR2AMEN1KMT2AFAAHHDAC1
SCHEMBL6664177 0.86 FAAH (0.41) HTR2AMEN1KMT2AFAAHHDAC1

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-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed