SCHEMBL7733320

SCHEMBL7733320

CCCCc1ccc(C(F)(F)Oc2ccc(OC(F)F)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.38
CETP P11597 1/20 0.37
BACE1 P56817 2/20 0.37
DAO P14920 1/20 0.36
KIF11 P52732 1/20 0.36
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
FAAH O00519 1/20 0.35
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.34
PSEN1 P49768 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
PLK1 P53350 1/20 0.34
THRB P10828 1/20 0.34
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 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
SCHEMBL7730399 1.00 PPARA (0.38) PPARACETPBACE1DAOKIF11
SCHEMBL7732522 0.99 DAO (0.39) PPARACETPBACE1DAOKIF11
SCHEMBL7735198 0.96 PPARA (0.43) PPARABACE1DAOMAPK1KMT2A
SCHEMBL7722558 0.96 PPARA (0.43) PPARABACE1DAOMAPK1KMT2A
SCHEMBL7734866 0.95 PPARA (0.42) PPARABACE1DAOMAPK1KMT2A
SCHEMBL7731001 0.92 PPARG (0.40) PPARACETPBACE1DAOMAPK1
SCHEMBL7732775 0.92 PPARG (0.40) PPARACETPBACE1DAOMAPK1
SCHEMBL7729751 0.90 DAO (0.40) PPARACETPBACE1DAOMAPK1
SCHEMBL7732798 0.90 CA2 (0.41) PPARAMAPK1KMT2AFAAHLMNA
SCHEMBL7730388 0.87 DAO (0.40) PPARADAOMAPK1KMT2ALMNA

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-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 EP disclosed
US-5858270-A Difluorooxymethane derivative and liquid crystal composition CHISSO CORPORATION (JP) 1999-01-12 US disclosed
EP-0786445-A1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-07-30 EP disclosed