SCHEMBL8045207

SCHEMBL8045207

CCC(C)CCC1CCC(c2cc(F)c(CCc3cc(F)c(OC(F)(F)F)c(F)c3)c(F)c2)CC1

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 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
SCHEMBL8043174 0.89 EPHX2 (0.32) EPHX2CHRM2CHRM5CHRM1CHRM3
SCHEMBL8045178 0.89 FFAR4 (0.33) CHRM2CHRM5CHRM1CHRM3
SCHEMBL8052428 0.87 EPHX2 (0.40) EPHX2CHRM2CHRM5
SCHEMBL8049212 0.87 CHRM2 (0.31) CHRM2CHRM5CHRM1CHRM3
SCHEMBL8045502 0.87 EPHX2 (0.31) EPHX2CHRM2CHRM5CHRM1CHRM3
SCHEMBL8049143 0.87 EPHX2 (0.38) EPHX2
SCHEMBL8045182 0.87 CHRM2 (0.31) CHRM2CHRM5CHRM1CHRM3
SCHEMBL8053791 0.86 DAO (0.32)
SCHEMBL8046242 0.84
SCHEMBL8043578 0.83 CHRM2 (0.33) CHRM2CHRM5CHRM1CHRM3

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