SCHEMBL8944272

SCHEMBL8944272

CCCCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)c(F)c2)CO1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 7/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
ALOX5 P09917 1/20 0.31
EPHX1 P07099 1/20 0.31
RARB P10826 1/20 0.31
PPARD Q03181 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 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
SCHEMBL8943493 0.99 FPR2 (0.34) FPR2PDE4APDE4BPDE4CPDE4D
SCHEMBL8944098 0.98 FPR2 (0.35) FPR2ALOX5EPHX1RARBPPARD
SCHEMBL8943876 0.98 FPR2 (0.35) FPR2ALOX5EPHX1RARBPPARD
SCHEMBL8943949 0.98 FPR2 (0.35) FPR2ALOX5EPHX1RARBPPARD
SCHEMBL8943537 0.98 FPR2 (0.35) FPR2ALOX5EPHX1RARBPPARD
SCHEMBL8944200 0.98 FPR2 (0.35) FPR2ALOX5EPHX1RARBPPARD
SCHEMBL8944391 0.98 FPR2 (0.35) FPR2ALOX5EPHX1RARBPPARD
SCHEMBL8944113 0.98 FPR2 (0.35) FPR2ALOX5EPHX1RARBPPARD
SCHEMBL8943530 0.98 FPR2 (0.35) FPR2ALOX5EPHX1RARBPPARD
SCHEMBL8943836 0.98 FPR2 (0.35) FPR2ALOX5EPHX1RARBPPARD

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-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