SCHEMBL7735446

SCHEMBL7735446

CCCc1cc(F)c(C(F)(F)Oc2ccc(C(F)(F)Oc3cc(F)c(OC(F)(F)F)c(F)c3)cc2)c(F)c1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
PDE2A O00408 1/20 0.30
TSHR P16473 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 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
SCHEMBL7732500 0.93 HDAC3 (0.33) PPARDPPARAFFAR4HDAC3HDAC1
SCHEMBL7722918 0.92 HDAC3 (0.33) PPARDPPARAFFAR4HDAC3HDAC1
SCHEMBL7732936 0.91
SCHEMBL7732166 0.90 PPARD (0.35) PPARDPPARAPDE2ATSHRHDAC3
SCHEMBL7731615 0.90 TSHR (0.35) PDE2ATSHRHDAC3HDAC1HDAC2
SCHEMBL7733390 0.89 DAO (0.37) PPARDPPARAFFAR4TSHR
SCHEMBL7732810 0.89 DAO (0.37) PPARDPPARAFFAR4TSHR
SCHEMBL7730397 0.89 DAO (0.33) PPARDPPARA
SCHEMBL7729113 0.89 MAOB (0.32)
SCHEMBL7734998 0.87 TAAR1 (0.33) PDE2ATSHRHCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9133397-B2 Tricyclic compound having a plurality of CF2O bonding groups, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2015-09-15 US disclosed
US-9133397-B2 Tricyclic compound having a plurality of CF2O bonding groups, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2015-09-15 US disclosed
US-20130271719-A1 TRICYCLIC COMPOUND HAVING A PLURALITY OF CF2O BONDING GROUPS, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-10-17 US disclosed
US-20130271719-A1 TRICYCLIC COMPOUND HAVING A PLURALITY OF CF2O BONDING GROUPS, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-10-17 US disclosed
EP-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 EP disclosed