SCHEMBL7911247

SCHEMBL7911247

CCCCCC1CCC(c2ccc(-c3cc(F)c(OC(F)(F)C(F)C(F)(F)F)c(F)c3)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
FFAR4 Q5NUL3 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
SPHK1 Q9NYA1 2/20 0.31

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
SCHEMBL7913636 0.93 CYP2C9 (0.39) MAPTFFAR4CYP2C9ALDH1A1LMNA
SCHEMBL7913661 0.89 GAA (0.33) MAPTGAAMEN1KMT2A
SCHEMBL7911103 0.89 MAPT (0.33) MAPTGAACYP2C9ALDH1A1LMNA
SCHEMBL8834634 0.88 MAPT (0.35) MAPTGAACYP2C9ALDH1A1LMNA
SCHEMBL8834271 0.88 FFAR4 (0.32) MAPTFFAR4ALDH1A1LMNAMEN1
SCHEMBL8834299 0.87 CYP2C9 (0.31) MAPTGAACYP2C9ALDH1A1LMNA
SCHEMBL8834530 0.87 FFAR4 (0.31) FFAR4CYP2C9
SCHEMBL8834541 0.87 CYP2C9 (0.37) MAPTFFAR4CYP2C9ALDH1A1LMNA
SCHEMBL8834962 0.86 FFAR4 (0.33) FFAR4
SCHEMBL7917348 0.86 ALDH1A1 (0.38) MAPTGAACYP2C9ALDH1A1LMNA

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-0640578-B2 Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition CHISSO CORP (JP) 2001-06-27 EP disclosed
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