SCHEMBL19985579

SCHEMBL19985579

C/C=C/CCC1CCC(c2ccc(-c3ccc(OCCCCC)c(F)c3F)c(F)c2F)CC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.32
ALOX5 P09917 1/20 0.32
PTGIR P43119 1/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 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
SCHEMBL19985578 0.99 CNR1 (0.32) PTGESALOX5PTGIRALOX5APFEN1
SCHEMBL19985575 0.99 CNR1 (0.32) PTGESALOX5PTGIRALOX5APFEN1
SCHEMBL19985573 0.99 CNR1 (0.32) PTGESALOX5PTGIRALOX5APFEN1
SCHEMBL19985580 0.99 CNR1 (0.32) PTGESALOX5PTGIRALOX5APFEN1
SCHEMBL19985572 0.97 ALOX5 (0.35) PTGESALOX5ALOX5APFEN1
SCHEMBL8935556 0.95 PTGES (0.31) PTGESALOX5
SCHEMBL8935506 0.94 CNR1 (0.31) PTGESALOX5CNR1CNR2
SCHEMBL8935546 0.94 CNR1 (0.31) PTGESALOX5CNR1CNR2
SCHEMBL8935549 0.94 CNR1 (0.31) PTGESALOX5CNR1CNR2
SCHEMBL8935569 0.94 CNR1 (0.31) PTGESALOX5CNR1CNR2

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