SCHEMBL6469174

SCHEMBL6469174

O=C(NS(=O)(=O)c1ccc(F)cc1)c1ccc(N(c2ccc(OC(F)F)c(OC(F)F)c2)C(O)c2cccnc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.52
PTGS1 P23219 3/20 0.44
EGFR P00533 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
BCL2L1 Q07817 2/20 0.40
MCL1 Q07820 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
POLB P06746 1/20 0.38
NAMPT P43490 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL6532215 0.81 PDE4D (0.43) PTGS2PTGS1EGFRPDE4APDE4B
SCHEMBL6527184 0.81 PTGS2 (0.42) PTGS2PDE4APDE4BPDE4CPDE4D
SCHEMBL6468561 0.77 GAA (0.40) PTGS2MEN1KMT2ANAMPTSMN1; SMN2
SCHEMBL4194215 0.76 PDE4A (0.51) PTGS2PTGS1MEN1KMT2APDE4A
SCHEMBL6071519 0.75 PTGS2 (0.55) PTGS2PTGS1EGFRBCL2L1MCL1
SCHEMBL4188752 0.74 PTGS2 (0.41) PTGS2PTGS1MEN1KMT2APDE4A
SCHEMBL6470005 0.72 MAPT (0.40) L3MBTL1MEN1KMT2APDE4APDE4B
SCHEMBL6528413 0.72 PIK3CA (0.42) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL2926474 0.72 POLB (0.55) PTGS2MEN1KMT2APDE4APDE4B
SCHEMBL6532108 0.70 PDE4D (0.42) PDE4APDE4BPDE4CPDE4DLMNA

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