SCHEMBL8833748

SCHEMBL8833748

CCCCCC1CCC(c2cc(F)c(-c3ccc(OC(F)(F)C(F)C(F)(F)F)c(F)c3)c(F)c2)CC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
RECQL P46063 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
SCHEMBL8834268 0.99 GAA (0.34) GAAMAPTRECQL
SCHEMBL8833775 0.93 CYP2C9 (0.33) MAPTRECQL
SCHEMBL7911103 0.90 MAPT (0.33) GAAMAPTRECQL
SCHEMBL7917430 0.90 MAPT (0.33) GAAMAPTRECQL
SCHEMBL7911157 0.90 GRIN2B (0.33) MAPTRECQL
SCHEMBL8834634 0.89 MAPT (0.35) GAAMAPTRECQL
SCHEMBL8834284 0.89 GAA (0.32) GAAMAPT
SCHEMBL7911870 0.88 ALDH1A1 (0.34) GAAMAPT
SCHEMBL8834281 0.88 GAA (0.33) GAAMAPT
SCHEMBL7913750 0.87 MAPT (0.35) GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640578-B1 Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition CHISSO CORP (JP) 1997-11-05 EP disclosed
EP-0640578-A1 Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition Chisso Corporation (JP) 1995-03-01 EP disclosed