SCHEMBL8959335

SCHEMBL8959335

C/C=C/C1CCC(C2CCC(c3ccc(-c4ccc(-c5ccc(OCCCC)c(F)c5F)cc4)c(F)c3)CC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
FASN P49327 1/20 0.32
PPARD Q03181 1/20 0.31
FPR2 P25090 1/20 0.30
KDM1A O60341 2/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
APP P05067 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
SCHEMBL8959339 0.97 FPR2 (0.32) FASNPPARDFPR2
SCHEMBL8933682 0.97 PDE4A (0.33) PDE4APDE4BPDE4CPDE4DFASN
SCHEMBL8959349 0.96 RARB (0.32) FASNPPARDFPR2
SCHEMBL8964820 0.96 RARB (0.32) FASNPPARDFPR2
SCHEMBL8959395 0.96 RARB (0.32) FASNPPARDFPR2
SCHEMBL8959341 0.96 RARB (0.32) FASNPPARDFPR2
SCHEMBL8959331 0.95 FPR2 (0.34) PDE4AFASNFPR2KDM1ACYP3A4
SCHEMBL8933435 0.94 FPR2 (0.33) PDE4APDE4BPDE4CPDE4DFASN
SCHEMBL8933708 0.94 RARB (0.34) PDE4APDE4BPDE4CPDE4DFASN
SCHEMBL8933654 0.94 RARB (0.34) PDE4APDE4BPDE4CPDE4DFASN

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