SCHEMBL8034378

SCHEMBL8034378

CCC(C)CCC1CCC(c2cc(F)c(-c3ccc(OC(F)(F)F)cc3)c(F)c2)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.35
PDE2A O00408 5/20 0.35
GPR88 Q9GZN0 1/20 0.33
SCN10A Q9Y5Y9 2/20 0.33
KDM1A O60341 1/20 0.33
RCOR1 Q9UKL0 1/20 0.33
JAK2 O60674 1/20 0.32
ROCK2 O75116 1/20 0.32
PRKD3 O94806 1/20 0.32
PRKCG P05129 1/20 0.32
PHKG2 P15735 1/20 0.32
RPS6KB1 P23443 1/20 0.32
MARK3 P27448 1/20 0.32
PRKCI P41743 1/20 0.32
CLK2 P49760 1/20 0.32
IRAK1 P51617 1/20 0.32
RPS6KA3 P51812 1/20 0.32
PRKCD Q05655 1/20 0.32
MAP4K2 Q12851 1/20 0.32
STK3 Q13188 1/20 0.32

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
SCHEMBL8034044 0.88 GRM2 (0.41) EPHX2PDE2AGPR88KDM1ARCOR1
SCHEMBL8052175 0.88 EPHX2 (0.39) EPHX2PDE2AGRM2
SCHEMBL8045198 0.87 JAK2 (0.36) EPHX2PDE2AGPR88SCN10AJAK2
SCHEMBL16579012 0.87 CYP2C9 (0.38) PDE2AKDM1ARCOR1MMP12L3MBTL1
SCHEMBL8045439 0.87 L3MBTL1 (0.40) EPHX2PDE2AGPR88SCN10AKDM1A
SCHEMBL8052426 0.86 CHRM4 (0.35) EPHX2PDE2AGPR88SCN10AMMP12
SCHEMBL8046242 0.86
SCHEMBL8052400 0.86 HTR2C (0.35) EPHX2PDE2AGPR88RPS6KB1
SCHEMBL16579011 0.85 KDM1A (0.37) PDE2ASCN10AKDM1ARCOR1JAK2
SCHEMBL8049143 0.85 EPHX2 (0.38) EPHX2PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733692-B1 Liquid crystalline compound, liquid crystal composition containing the same, and display device CHISSO CORP (JP) 2000-06-14 EP disclosed
US-5714088-A TRIFLUOROMETHYL- OR -METHOXYPHENYL-SUBSTITUTED BRANCHED ALKYL-SUBSTITUTED CYCLOHEXANES; LARGE POSITIVE VALUE OF DIELECTRIC ANISOTROPY; VERY LOW VISCOSITY; HIGH VOLTAGE HOLDING RATIO(SPECIFIC RESISTANCE); UV STABILITY CHISSO CORPORATION (JP) 1998-02-03 US disclosed
EP-0733692-A1 Liquid crystalline compound, liquid crystal composition containing the same, and display device Chisso Corporation (JP) 1996-09-25 EP disclosed