SCHEMBL8138446

SCHEMBL8138446

Nc1cc(F)c(C(F)(F)F)c(Oc2ccc(C(F)(F)F)c(Oc3c(F)c(N)cc(F)c3C(F)(F)F)c2)c1F

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.37
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.33
KCNH2 Q12809 1/20 0.33
MAPT P10636 2/20 0.32
KIF11 P52732 1/20 0.32
POLB P06746 1/20 0.32
HSP90AA1 P07900 1/20 0.32
SCN9A Q15858 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL8144471 0.89 AR (0.37) ARALOX5APFEN1HTR2ASLC6A4
SCHEMBL8137871 0.89 AR (0.38) ARALOX5APFEN1HTR2ASLC6A4
SCHEMBL8147207 0.83 AR (0.41) ARALOX5APFEN1HTR2ASLC6A4
SCHEMBL8146989 0.83 ALOX5AP (0.38) ARALOX5APFEN1HTR2ASLC6A4
SCHEMBL8145055 0.83 KDM4E (0.31) MAPTKDM4ECRHBPCRHR2
SCHEMBL8153387 0.82 ALOX5AP (0.36) ARALOX5APFEN1HTR2ASLC6A4
SCHEMBL8144990 0.82 ALOX5AP (0.36) ARALOX5APFEN1HTR2ASLC6A4
SCHEMBL8144246 0.82 KIF11 (0.33) MAPTKIF11KDM4ECRHBPCRHR2
SCHEMBL8145304 0.82 AR (0.43) ARALOX5APFEN1HTR2ASLC6A4
SCHEMBL8137751 0.82 KDM4E (0.30) MAPTHSP90AA1KDM4ECRHBPCRHR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6103860-A LOW DIELECTRIC CONSTANT, EXCELLENT TRANSPARENCY, LOW HYGROSCOPICITY AND EXCELLENT PROCESSABILITY; SUBSTRATE FOR AN OPTICAL DISK, A PICK-UP LENS, A PLASTIC SUBSTRATE FOR A LIQUID CELL AND A PRISM MITSUI CHEMICALS, INC. (JP) 2000-08-15 US disclosed
US-5990261-A Organic optical component MITSUI CHEMICALS, INC. (JP) 1999-11-23 US disclosed
EP-0826717-A1 An organic optical component MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1998-03-04 EP disclosed