SCHEMBL5214950

SCHEMBL5214950

COc1ccc(C2CC(=O)N(CCOS(C)(=O)=O)C2)cc1OC1CCCO1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 14/20 0.51
PDE4B Q07343 15/20 0.50
PDE4C Q08493 9/20 0.50
PDE4D Q08499 9/20 0.50

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
SCHEMBL3541867 1.00 PDE4A (0.51) PDE4APDE4BPDE4CPDE4D
SCHEMBL5807740 0.86 PDE4A (0.53) PDE4APDE4BPDE4CPDE4D
SCHEMBL4462030 0.86 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL5762460 0.85 PDE4A (0.55) PDE4APDE4BPDE4CPDE4D
SCHEMBL5760783 0.85 PDE4A (0.55) PDE4APDE4BPDE4CPDE4D
SCHEMBL4466548 0.84 PDE4A (0.54) PDE4APDE4BPDE4CPDE4D
SCHEMBL5255366 0.83 PDE4A (0.54) PDE4APDE4BPDE4CPDE4D
SCHEMBL3551154 0.82 PDE4A (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL5194511 0.82 PDE4A (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL3539215 0.82 PDE4A (0.47) PDE4APDE4BPDE4CPDE4D

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-1802615-A1 PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceuticals Corporation (US) 2007-07-04 EP disclosed
WO-2006044955-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2006-04-27 WO disclosed