SCHEMBL19985464

SCHEMBL19985464

CCCCCOc1ccc(-c2ccc(C3CCC(CC)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 5/20 0.33
FEN1 P39748 5/20 0.33
FPR2 P25090 3/20 0.33
SCN9A Q15858 1/20 0.33
CNR1 P21554 3/20 0.32
CNR2 P34972 3/20 0.32
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
MCHR1 Q99705 2/20 0.32
IKBKB O14920 3/20 0.32
CYP2C9 P11712 1/20 0.32
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
SCHEMBL19985476 0.99 CNR1 (0.34) ALOX5APFEN1FPR2SCN9ACNR1
SCHEMBL19985466 0.99 CNR1 (0.34) ALOX5APFEN1FPR2SCN9ACNR1
SCHEMBL19985475 0.99 CNR1 (0.34) ALOX5APFEN1FPR2SCN9ACNR1
SCHEMBL19985473 0.99 CNR1 (0.34) ALOX5APFEN1FPR2SCN9ACNR1
SCHEMBL19985470 0.96 SCN9A (0.36) ALOX5APFEN1FPR2SCN9AHTR1D
SCHEMBL9630338 0.95 SCN9A (0.35) FPR2SCN9ACNR1CNR2HTR1D
SCHEMBL9630343 0.95 SCN9A (0.35) FPR2SCN9ACNR1CNR2HTR1D
SCHEMBL9406427 0.94 CNR1 (0.36) FPR2SCN9ACNR1CNR2HTR1D
SCHEMBL9406431 0.94 CNR1 (0.36) FPR2SCN9ACNR1CNR2HTR1D
SCHEMBL19985468 0.93 FPR2 (0.38) ALOX5APFEN1FPR2HTR1DHTR1B

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