SCHEMBL19985545

SCHEMBL19985545

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

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.33
ALOX5AP P20292 2/20 0.32
FEN1 P39748 2/20 0.32
FPR2 P25090 2/20 0.31
PTGES O14684 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL19985550 0.97 ALOX5AP (0.32) SCN9AALOX5APFEN1FPR2
SCHEMBL19985555 0.96 CNR1 (0.33) SCN9AALOX5APFEN1FPR2
SCHEMBL19985547 0.96 CNR1 (0.33) SCN9AALOX5APFEN1FPR2
SCHEMBL19985554 0.96 CNR1 (0.33) SCN9AALOX5APFEN1FPR2
SCHEMBL19985553 0.96 CNR1 (0.33) SCN9AALOX5APFEN1FPR2
SCHEMBL19985548 0.94 FPR2 (0.35) ALOX5APFEN1FPR2
SCHEMBL19985250 0.92 SCN9A (0.33) SCN9APTGESALOX5
SCHEMBL19985557 0.91 SCN9A (0.33) SCN9AALOX5APFEN1FPR2
SCHEMBL19985546 0.91 FPR2 (0.33) ALOX5APFEN1FPR2
SCHEMBL19985572 0.89 ALOX5 (0.35) SCN9AALOX5APFEN1FPR2PTGES

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