SCHEMBL7731273

SCHEMBL7731273

CCCc1ccc(C(F)(F)Oc2ccc(C(F)(F)Oc3cc(F)c(OC(F)F)c(F)c3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CETP P11597 1/20 0.34
PSMB5 P28074 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
PDE2A O00408 1/20 0.31
DAO P14920 1/20 0.31
MAOB P27338 1/20 0.31
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30
THRB P10828 1/20 0.30
FFAR1 O14842 1/20 0.30
CYP2C9 P11712 1/20 0.30
KCNH2 Q12809 1/20 0.30
CACNA1C Q13936 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL7733206 0.97 CETP (0.33) CETPPSMB5SENP8SENP7SENP6
SCHEMBL7735193 0.94 CETP (0.33) CETPPSMB5SENP8SENP7SENP6
SCHEMBL7730361 0.93 CETP (0.36) CETPPDE2ADAOPPARGPPARA
SCHEMBL7722822 0.92 HTR2A (0.35) CETPPPARGPPARATHRBMEN1
SCHEMBL7731674 0.92 MAOB (0.33) CETPPSMB5MAOBPPARGPPARA
SCHEMBL7731837 0.91 FFAR1 (0.30) FFAR1
SCHEMBL7731382 0.91
SCHEMBL7722495 0.90 CETP (0.35) CETPPPARGPPARA
SCHEMBL7733355 0.90 PDE2A (0.34) PDE2AFFAR1CYP2C9KCNH2CACNA1C
SCHEMBL7730452 0.89 HTR2A (0.36) CETPPPARGPPARATHRB

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 1 patent. 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