SCHEMBL8034379

SCHEMBL8034379

CC(C)CCCC1CCC(c2ccc(CCc3cc(F)c(C(F)(F)F)c(F)c3)c(F)c2)CC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
DAO P14920 1/20 0.31
RORC P51449 1/20 0.30
POLQ O75417 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
SCHEMBL8046509 0.89 SPHK1 (0.35) SLC6A2SLC6A4DAO
SCHEMBL8748020 0.88 SPHK1 (0.34) DAORORCPOLQ
SCHEMBL8043804 0.88 KDM1A (0.34) SLC6A2SLC6A4SLC6A3DAOPOLQ
SCHEMBL8044892 0.88 SLC6A4 (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL8748217 0.87 SPHK1 (0.36) DAORORC
SCHEMBL8044790 0.87 CHRM2 (0.31)
SCHEMBL8049058 0.87 DAO (0.30) DAORORC
SCHEMBL8747894 0.86 SPHK1 (0.38) DAO
SCHEMBL8748190 0.86 SPHK1 (0.38) DAO
SCHEMBL8045443 0.86 DAO (0.32) DAO

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