SCHEMBL8933682

SCHEMBL8933682

C/C=C/C1CCC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)c(F)c2)CC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
FASN P49327 1/20 0.33
PPARD Q03181 2/20 0.33
KDM1A O60341 2/20 0.32
FPR2 P25090 2/20 0.32
CYP3A4 P08684 2/20 0.31
CYP2C9 P11712 2/20 0.31
APP P05067 2/20 0.31
FFAR4 Q5NUL3 1/20 0.31
SCN9A Q15858 1/20 0.31
CNR2 P34972 2/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
CNR1 P21554 1/20 0.31
S1PR1 P21453 1/20 0.30
S1PR3 Q99500 1/20 0.30
ALOX5AP P20292 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
SCHEMBL8959335 0.97 PDE4A (0.32) PDE4APDE4BPDE4CPDE4DFASN
SCHEMBL8933435 0.97 FPR2 (0.33) PDE4APDE4BPDE4CPDE4DFASN
SCHEMBL8933647 0.96 RARB (0.34) PDE4APDE4BPDE4CPDE4DFASN
SCHEMBL8933708 0.96 RARB (0.34) PDE4APDE4BPDE4CPDE4DFASN
SCHEMBL8933654 0.96 RARB (0.34) PDE4APDE4BPDE4CPDE4DFASN
SCHEMBL8933584 0.96 RARB (0.34) PDE4APDE4BPDE4CPDE4DFASN
SCHEMBL8933505 0.95 FPR2 (0.35) PDE4AFASNKDM1AFPR2CYP3A4
SCHEMBL8959339 0.94 FPR2 (0.32) FASNPPARDFPR2
SCHEMBL8959341 0.94 RARB (0.32) FASNPPARDFPR2
SCHEMBL8959349 0.94 RARB (0.32) FASNPPARDFPR2

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