SCHEMBL8045933

SCHEMBL8045933

CC(C)CCCC1CCC(C2CCC(=O)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
TLR4 O00206 2/20 0.34

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
SCHEMBL4269516 0.89 MAPT (0.37) MAPTTLR4
SCHEMBL7782150 0.80 CYP1A2 (0.47) MAPTTLR4
SCHEMBL6752745 0.80 CYP1A2 (0.47) MAPTTLR4
SCHEMBL6734843 0.80 CYP1A2 (0.47) MAPTTLR4
SCHEMBL876348 0.79
SCHEMBL13378068 0.79 CYP1A2 (0.46) MAPTTLR4
SCHEMBL1255189 0.79 CYP1A2 (0.46) MAPTTLR4
SCHEMBL2892324 0.79 CYP1A2 (0.46) MAPTTLR4
SCHEMBL6910065 0.79 CYP1A2 (0.46) MAPTTLR4
SCHEMBL17459591 0.78 TLR4 (0.31) MAPTTLR4

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