SCHEMBL8734647

SCHEMBL8734647

CCCCCC[C@H]1CC[C@H](/C=C/[C@H]2CC[C@H](c3cc(F)c(F)c(F)c3)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
SPHK1 Q9NYA1 3/20 0.33
CYP2C9 P11712 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.30
CYP1A2 P05177 2/20 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
SCHEMBL8737406 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL8737408 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL8737097 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL8737100 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL8734655 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL8736472 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL8737403 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL8733428 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL8736468 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL8733432 1.00 MAPT (0.36) MAPTGAAMEN1KMT2ASPHK1

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-0688754-B1 DICYCLOHEXYLETHYLENE DERIVATIVE CHISSO CORP (JP) 1998-10-07 EP disclosed
US-5641432-A USEFUL IN LIQUID CRYSTAL COMPOSITIONS; WIDE LIQUID CRYSTAL PHASE TEMPERATURE RANGE, LOW VISCOSITY, HIGH STABILITY; COMPATIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS CHISSO CORPORATION (JP) 1997-06-24 US disclosed
EP-0688754-A1 DICYCLOHEXYLETHYLENE DERIVATIVE CHISSO CORPORATION (JP) 1995-12-27 EP disclosed