SCHEMBL7914725

SCHEMBL7914725

COc1ccc(C(O)(Cc2ccncc2)c2ccccc2OC)cc1OC1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 19/20 0.54
PDE4D Q08499 5/20 0.53
PDE4B Q07343 4/20 0.53
PDE4C Q08493 4/20 0.53

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
SCHEMBL6508090 0.90 PDE4A (0.58) PDE4APDE4DPDE4BPDE4C
SCHEMBL7314363 0.89 PDE4A (0.54) PDE4APDE4DPDE4BPDE4C
SCHEMBL7900925 0.86 PDE4A (0.59) PDE4APDE4DPDE4BPDE4C
SCHEMBL7911130 0.85 PDE4A (0.59) PDE4APDE4DPDE4BPDE4C
SCHEMBL7907983 0.85 PDE4A (0.50) PDE4APDE4DPDE4BPDE4C
SCHEMBL6886593 0.85 PDE4A (0.51) PDE4APDE4DPDE4BPDE4C
SCHEMBL7322059 0.84 PDE4A (0.49) PDE4APDE4DPDE4BPDE4C
SCHEMBL7314136 0.83 PDE4A (0.48) PDE4APDE4DPDE4BPDE4C
SCHEMBL8770460 0.83 PDE4A (0.55) PDE4APDE4DPDE4BPDE4C
SCHEMBL6758010 0.80 PDE4A (0.51) 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
EP-0626939-B1 TRI-SUBSTITUTED PHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 2001-11-07 EP disclosed