SCHEMBL6532215

SCHEMBL6532215

O=C(NS(=O)(=O)c1ccc(F)c(F)c1)c1ccc(N(c2ccc(OC(F)F)c(O[C@@H]3CCOC3)c2)C(O)c2cccnc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 14/20 0.43
PDE4A P27815 9/20 0.42
PDE4B Q07343 9/20 0.42
PDE4C Q08493 9/20 0.42
PTGS2 P35354 2/20 0.34
RORC P51449 1/20 0.34
GRM4 Q14833 1/20 0.33
EGFR P00533 2/20 0.33
PTGS1 P23219 1/20 0.33
ATR Q13535 1/20 0.32
ITK Q08881 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
SCHEMBL6526545 0.89 PDE4D (0.41) PDE4DPDE4APDE4BPDE4CRORC
SCHEMBL6527184 0.86 PTGS2 (0.42) PDE4DPDE4APDE4BPDE4CPTGS2
SCHEMBL6532108 0.83 PDE4D (0.42) PDE4DPDE4APDE4BPDE4C
SCHEMBL6528413 0.82 PIK3CA (0.42) PDE4DPDE4APDE4BPDE4C
SCHEMBL6469174 0.81 PTGS2 (0.52) PDE4DPDE4APDE4BPDE4CPTGS2
SCHEMBL6529700 0.81 PDE4D (0.45) PDE4DPDE4APDE4BPDE4C
SCHEMBL6532820 0.81 PDE4D (0.50) PDE4DPDE4APDE4BPDE4C
SCHEMBL2925618 0.81 PDE4D (0.40) PDE4DPDE4APDE4BPDE4CPTGS2
SCHEMBL2925598 0.78 PDE4D (0.47) PDE4DPDE4APDE4BPDE4CGRM4
SCHEMBL6468561 0.77 GAA (0.40) PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569908-A2 PYRIDINE N-OXIDE COMPOUNDS AS PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceutical Corporation (US) 2005-09-07 EP disclosed
WO-2004046113-A2 PYRIDINE N-OXIDE COMPOUNDS AS PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2004-06-03 WO disclosed