SCHEMBL19986386

SCHEMBL19986386

C/C=C/COc1ccc(-c2ccc(C3CCCCC3)c(F)c2F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.36
FEN1 P39748 17/20 0.36
ALOX5AP P20292 13/20 0.36
PTGDR Q13258 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
SCHEMBL19985583 0.89 ALOX5AP (0.32) FEN1ALOX5AP
SCHEMBL19986361 0.88 PTGDR2 (0.33) PTGDR2PTGDR
SCHEMBL19985590 0.87 HTR1A (0.31) FEN1ALOX5AP
SCHEMBL19985597 0.86 HTR1A (0.32)
SCHEMBL19986380 0.85 HTR2C (0.38) PTGDR2FEN1ALOX5APPTGDR
SCHEMBL19986372 0.84 PTGDR2 (0.40) PTGDR2FEN1ALOX5APPTGDR
SCHEMBL19985600 0.83 MEN1 (0.32)
SCHEMBL19986430 0.83 CYP3A4 (0.38) PTGDR2FEN1ALOX5APPTGDR
SCHEMBL19985608 0.82 GAA (0.32)
SCHEMBL19985623 0.81 GAA (0.34)

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-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 US disclosed