SCHEMBL3131836

SCHEMBL3131836

COc1ccc(C(N)c2cnco2)cc1OC1CC1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 19/20 0.45
PDE4D Q08499 3/20 0.44
PDE4B Q07343 2/20 0.44
PDE4C Q08493 2/20 0.44

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
SCHEMBL3128689 0.95 PDE4A (0.48) PDE4APDE4DPDE4BPDE4C
SCHEMBL3121033 0.82 ALDH1A1 (0.42) PDE4APDE4DPDE4BPDE4C
SCHEMBL3120367 0.82 L3MBTL1 (0.39) PDE4APDE4DPDE4BPDE4C
SCHEMBL3126032 0.82 PDE4A (0.46) PDE4APDE4DPDE4BPDE4C
SCHEMBL3132672 0.82 PDE4B (0.45) PDE4APDE4DPDE4BPDE4C
SCHEMBL3131094 0.81 PDE4A (0.47) PDE4APDE4DPDE4BPDE4C
SCHEMBL3131223 0.81 L3MBTL1 (0.40)
SCHEMBL3121296 0.80 L3MBTL1 (0.39) PDE4APDE4DPDE4BPDE4C
SCHEMBL3117583 0.80 MAPT (0.44)
SCHEMBL3133274 0.77 PDE4A (0.54) PDE4APDE4DPDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO disclosed