SCHEMBL8833946

SCHEMBL8833946

CCCOCC1CCC(c2ccc(-c3ccc(OC(F)(F)C(F)C(F)(F)F)c(F)c3)cc2)CC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.32
RECQL P46063 1/20 0.30
CTSK P43235 1/20 0.30
NAAA Q02083 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
SCHEMBL8834171 0.92 RECQL (0.31) FFAR4RECQLCTSKNAAA
SCHEMBL8834533 0.89 FFAR4 (0.32) FFAR4
SCHEMBL7914144 0.89 CYP2C9 (0.39) FFAR4RECQLCTSKNAAA
SCHEMBL7903766 0.88 RECQL (0.32) FFAR4RECQLCTSKNAAA
SCHEMBL8834763 0.87 RECQL (0.31) RECQL
SCHEMBL8834409 0.87 ESR2 (0.33) RECQL
SCHEMBL8833736 0.87 NAAA (0.33) CTSKNAAA
SCHEMBL7911103 0.86 MAPT (0.33) RECQL
SCHEMBL7914161 0.86 ALDH1A1 (0.36)
SCHEMBL8834634 0.85 MAPT (0.35) RECQL

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