SCHEMBL6666069

SCHEMBL6666069

C=CC1CCC(CC(F)(F)OCc2ccc(CCC)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.36
MAOA P21397 1/20 0.32
MAOB P27338 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
SCHEMBL6666065 1.00 THRB (0.36) THRBMAOAMAOB
SCHEMBL6660752 0.92 THRB (0.40) THRB
SCHEMBL6660757 0.92 THRB (0.40) THRB
SCHEMBL6665219 0.90
SCHEMBL6665225 0.90
SCHEMBL6663158 0.89 THRB (0.35) THRBMAOAMAOB
SCHEMBL6663149 0.89 THRB (0.35) THRBMAOAMAOB
SCHEMBL6665259 0.87 AGXT (0.33)
SCHEMBL6665253 0.87 AGXT (0.33)
SCHEMBL6666414 0.86 MAOA (0.32) THRBMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed