SCHEMBL8935532

SCHEMBL8935532

C/C=C/CCC1CCC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
SCN9A Q15858 1/20 0.31
ALOX5AP P20292 2/20 0.30
FEN1 P39748 2/20 0.30
FPR2 P25090 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
SCHEMBL8962944 0.97 PTGES (0.32) PTGESALOX5
SCHEMBL8935556 0.97 PTGES (0.31) PTGESALOX5FPR2
SCHEMBL8935546 0.96 CNR1 (0.31) PTGESALOX5FPR2
SCHEMBL8935549 0.96 CNR1 (0.31) PTGESALOX5FPR2
SCHEMBL8935569 0.96 CNR1 (0.31) PTGESALOX5FPR2
SCHEMBL8935506 0.96 CNR1 (0.31) PTGESALOX5FPR2
SCHEMBL8935482 0.95 FPR2 (0.34) ALOX5APFEN1FPR2
SCHEMBL19985572 0.95 ALOX5 (0.35) PTGESALOX5SCN9AALOX5APFEN1
SCHEMBL8962796 0.94 PTGES (0.30) PTGESALOX5FPR2
SCHEMBL8962918 0.94

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed