SCHEMBL8137251

SCHEMBL8137251

Nc1c(F)c(F)cc(Oc2ccc(C(F)(F)F)c(Oc3cc(F)c(F)c(N)c3F)c2)c1F

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AR P10275 13/20 0.40
SCN9A Q15858 3/20 0.37
HTR2A P28223 1/20 0.37
SLC6A4 P31645 1/20 0.37
KCNH2 Q12809 1/20 0.37
KIF11 P52732 1/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33

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
SCHEMBL8146194 0.89 AR (0.39) ARSCN9AHTR2ASLC6A4KCNH2
SCHEMBL8147333 0.89 AR (0.39) ARSCN9AHTR2ASLC6A4KCNH2
SCHEMBL8139377 0.85 AR (0.43) ARHTR2ASLC6A4KCNH2
SCHEMBL8152244 0.85 AR (0.40) ARSCN9AHTR2ASLC6A4KCNH2
SCHEMBL8145826 0.85 AR (0.42) ARHTR2ASLC6A4KCNH2
SCHEMBL8152815 0.84 AR (0.32) ARSCN9A
SCHEMBL8153131 0.83 HTR2A (0.32) ARHTR2AKIF11
SCHEMBL8152049 0.81 AR (0.38) ARSCN9AHTR2ASLC6A4KCNH2
SCHEMBL8138014 0.81 AR (0.38) ARSCN9AHTR2ASLC6A4KCNH2
SCHEMBL8144981 0.80 AR (0.31) ARHTR2AKIF11

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