SCHEMBL6663838

SCHEMBL6663838

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.39
FAAH O00519 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
EPHX1 P07099 1/20 0.37
HTR2A P28223 1/20 0.36
ALOX5 P09917 1/20 0.36
PPARG P37231 1/20 0.36
THRB P10828 2/20 0.36
TSHR P16473 1/20 0.36
DAO P14920 1/20 0.36
STS P08842 1/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
THRA P10827 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL6667383 0.99 FAAH (0.41) PDE2AFAAHHDAC3HDAC1HDAC2
SCHEMBL6666331 0.99 FAAH (0.41) PDE2AFAAHHDAC3HDAC1HDAC2
SCHEMBL6662969 0.99 FAAH (0.41) PDE2AFAAHHDAC3HDAC1HDAC2
SCHEMBL6667590 0.99 FAAH (0.41) PDE2AFAAHHDAC3HDAC1HDAC2
SCHEMBL6664177 0.99 FAAH (0.41) PDE2AFAAHHDAC3HDAC1HDAC2
SCHEMBL6666707 0.91 PDE2A (0.42) PDE2AHDAC3HDAC1HDAC2EPHX1
SCHEMBL6662955 0.91 HTR2A (0.42) FAAHHTR2ASLC6A4SLC6A3ALDH1A1
SCHEMBL6666975 0.90 FAAH (0.43) FAAHHTR2ASLC6A4SLC6A3ALDH1A1
SCHEMBL6662750 0.89 HTR2A (0.40) FAAHHTR2ASLC6A4SLC6A3ALDH1A1
SCHEMBL6661968 0.89 HTR2A (0.40) FAAHHTR2ASLC6A4SLC6A3ALDH1A1

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