SCHEMBL19985557

SCHEMBL19985557

CC/C=C\CC1CCC(c2ccc(-c3ccc(OCCCC)c(F)c3F)c(F)c2F)CC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.33
FPR2 P25090 2/20 0.31
ALOX5AP P20292 2/20 0.31
FEN1 P39748 2/20 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
SCHEMBL19985559 0.97 FPR2 (0.31) SCN9AFPR2ALOX5APFEN1
SCHEMBL19985562 0.96 CNR1 (0.31) SCN9AFPR2ALOX5APFEN1
SCHEMBL19985563 0.96 CNR1 (0.31) SCN9AFPR2ALOX5APFEN1
SCHEMBL19985561 0.96 CNR1 (0.31) SCN9AFPR2ALOX5APFEN1
SCHEMBL19985556 0.96 CNR1 (0.31) SCN9AFPR2ALOX5APFEN1
SCHEMBL19985560 0.94 FPR2 (0.35) FPR2ALOX5APFEN1
SCHEMBL19985252 0.92 SCN9A (0.33) SCN9A
SCHEMBL19985545 0.91 SCN9A (0.33) SCN9AFPR2ALOX5APFEN1
SCHEMBL19985558 0.91 FPR2 (0.33) FPR2ALOX5APFEN1
SCHEMBL19985229 0.89 SCN9A (0.31) SCN9AFPR2

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