SCHEMBL7722836

SCHEMBL7722836

CCCCC1CCC(CCc2ccc(C(F)(F)Oc3cc(F)c(OC(F)(F)F)c(F)c3)cc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.33
MAOB P27338 3/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
KMT2A Q03164 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
MAOA P21397 1/20 0.31
DPP4 P27487 2/20 0.31
MOGAT2 Q3SYC2 1/20 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
SCHEMBL7722833 1.00 HRH3 (0.33) HRH3MAOBHCRTR1HCRTR2KMT2A
SCHEMBL7731369 0.97 MAOB (0.32) HRH3MAOBHCRTR1HCRTR2FFAR4
SCHEMBL7731377 0.97 MAOB (0.32) HRH3MAOBHCRTR1HCRTR2FFAR4
SCHEMBL7729478 0.93 MAOB (0.33) MAOBHCRTR1HCRTR2FFAR4MAOA
SCHEMBL7729485 0.93 MAOB (0.33) MAOBHCRTR1HCRTR2FFAR4MAOA
SCHEMBL7723006 0.91 MAOB (0.33) MAOBHCRTR1HCRTR2FFAR4
SCHEMBL7723003 0.91 MAOB (0.33) MAOBHCRTR1HCRTR2FFAR4
SCHEMBL7722857 0.90 HRH3 (0.34) HRH3MAOBKMT2AMAOADPP4
SCHEMBL7722855 0.90 HRH3 (0.34) HRH3MAOBKMT2AMAOADPP4
SCHEMBL7733362 0.89 HRH3 (0.31) HRH3MAOBMOGAT2

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 4 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-0786508-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORP (JP) 2001-01-17 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