SCHEMBL7680255

SCHEMBL7680255

CCCCN1C(=O)C(S(=O)(=O)C(F)(F)F)C(=O)N(CCC)C1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
CNR2 P34972 3/20 0.33
CNR1 P21554 1/20 0.33
RAB9A P51151 1/20 0.32
PTGS1 P23219 3/20 0.31
PTGS2 P35354 3/20 0.31
MGLL Q99685 2/20 0.31
FAAH O00519 1/20 0.31
POLB P06746 1/20 0.31
CYP19A1 P11511 1/20 0.31
AGTR1 P30556 1/20 0.31
CASP3 P42574 2/20 0.30
CASP7 P55210 2/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL7677067 0.86 MAPT (0.31) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL7680940 0.71 SMN1; SMN2 (0.44) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL7674510 0.70 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL31681885 0.66 SMN1; SMN2 (0.43) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL11383456 0.64 ELANE (0.44) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL11473997 0.63 GAA (0.47) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL1362944 0.62 GAA (0.47) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL11482817 0.61 GAA (0.50) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL27722450 0.61 GAA (0.46) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL14998121 0.61 SMN1; SMN2 (0.53) PDE4APDE4BPDE4CPDE4DSMN1; SMN2

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-2380882-A1 Salts of heterocyclic anions and their uses as ionic conductive materials HYDRO QUEBEC (CA) 2011-10-26 EP disclosed
US-6365068-B1 IN SOLVENT HYDRO-QUEBEC (CA) 2002-04-02 US disclosed
US-6171522-B1 Heterocyclic aromatic anion salts, and their uses as ionic conducting materials Hydro-Qu{acute over (e)}bec (CA) 2001-01-09 US disclosed