SCHEMBL7731372

SCHEMBL7731372

CC[C@H]1CC[C@H](CCc2ccc(C(F)(F)Oc3ccc(OC(F)(F)F)c(F)c3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.37
EPHX2 P34913 5/20 0.35
HCRTR1 O43613 6/20 0.34
HCRTR2 O43614 6/20 0.34
MCHR1 Q99705 1/20 0.34
SLC7A5 Q01650 1/20 0.33
PDE2A O00408 1/20 0.33

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
SCHEMBL7731379 1.00 FFAR4 (0.37) FFAR4EPHX2HCRTR1HCRTR2MCHR1
SCHEMBL7730471 0.94 FFAR4 (0.37) FFAR4EPHX2HCRTR1HCRTR2MCHR1
SCHEMBL7730477 0.94 FFAR4 (0.37) FFAR4EPHX2HCRTR1HCRTR2MCHR1
SCHEMBL7735326 0.92 FFAR4 (0.36) FFAR4EPHX2HCRTR1HCRTR2MCHR1
SCHEMBL7735328 0.92 FFAR4 (0.36) FFAR4EPHX2HCRTR1HCRTR2MCHR1
SCHEMBL7735101 0.91 FFAR4 (0.36) FFAR4EPHX2HCRTR1HCRTR2MCHR1
SCHEMBL7735104 0.91 FFAR4 (0.36) FFAR4EPHX2HCRTR1HCRTR2MCHR1
SCHEMBL7733337 0.89 PDE4A (0.34) FFAR4HCRTR1HCRTR2
SCHEMBL7733335 0.89 PDE4A (0.34) FFAR4HCRTR1HCRTR2
SCHEMBL7915593 0.89 MAOB (0.34) FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 EP disclosed
EP-0786509-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORP (JP) 2001-09-12 EP disclosed
EP-0786508-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORP (JP) 2001-01-17 EP disclosed
EP-0786509-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORPORATION (JP) 1997-07-30 EP disclosed
EP-0786508-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORPORATION (JP) 1997-07-30 EP disclosed
EP-0786445-A1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-07-30 EP disclosed