SCHEMBL6532108

SCHEMBL6532108

COc1ccc(N(c2ccc(C(=O)NS(=O)(=O)c3ccccc3F)cc2)C(O)c2cccnc2)cc1O[C@@H]1CCOC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.42
PDE4A P27815 9/20 0.42
PDE4B Q07343 8/20 0.42
PDE4C Q08493 7/20 0.42
LMNA P02545 1/20 0.38
LTC4S Q16873 1/20 0.36

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
SCHEMBL6528413 0.93 PIK3CA (0.42) PDE4DPDE4APDE4BPDE4C
SCHEMBL6527184 0.90 PTGS2 (0.42) PDE4DPDE4APDE4BPDE4CLMNA
SCHEMBL6529700 0.89 PDE4D (0.45) PDE4DPDE4APDE4BPDE4C
SCHEMBL2926103 0.87 PDE4D (0.42) PDE4DPDE4APDE4BPDE4CLMNA
SCHEMBL6532215 0.83 PDE4D (0.43) PDE4DPDE4APDE4BPDE4C
SCHEMBL2931748 0.81 PIK3CA (0.43) PDE4DPDE4APDE4BPDE4C
SCHEMBL2925618 0.77 PDE4D (0.40) PDE4DPDE4APDE4BPDE4C
SCHEMBL2932029 0.77 PDE4D (0.46) PDE4DPDE4APDE4BPDE4CLMNA
SCHEMBL2924650 0.77 PTGS2 (0.47) PDE4DPDE4APDE4BPDE4CLMNA
SCHEMBL6469431 0.76 PDE4D (0.46) PDE4DPDE4APDE4BPDE4C

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 claimed
WO-2004046113-A2 PYRIDINE N-OXIDE COMPOUNDS AS PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2004-06-03 WO claimed