SCHEMBL5755474

SCHEMBL5755474

COc1ccc(C2CN(Cc3ccccc3)CC2(C)[C@@H](C)O)cc1OC1Cc2ccccc2C1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.50
PDE4A P27815 8/20 0.44
PDE4C Q08493 6/20 0.42
PDE4D Q08499 6/20 0.42

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
SCHEMBL5361396 1.00 PDE4B (0.50) PDE4BPDE4APDE4CPDE4D
SCHEMBL14575579 1.00 PDE4B (0.50) PDE4BPDE4APDE4CPDE4D
SCHEMBL5361391 1.00 PDE4B (0.50) PDE4BPDE4APDE4CPDE4D
SCHEMBL5351643 0.90 PDE4A (0.54) PDE4BPDE4APDE4CPDE4D
SCHEMBL5358605 0.90 PDE4A (0.54) PDE4BPDE4APDE4CPDE4D
SCHEMBL14575983 0.90 PDE4A (0.54) PDE4BPDE4APDE4CPDE4D
SCHEMBL5358600 0.90 PDE4A (0.54) PDE4BPDE4APDE4CPDE4D
SCHEMBL5351649 0.90 PDE4A (0.54) PDE4BPDE4APDE4CPDE4D
SCHEMBL5355685 0.85 MAPK1 (0.47) PDE4BPDE4APDE4CPDE4D
SCHEMBL5355688 0.85 MAPK1 (0.47) PDE4BPDE4APDE4CPDE4D

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-1242400-B1 PYRROLIDINE DERIVATIVES AS CYCLIC AMP-SPECIFIC PHOSPHODIESTERASE INHIBITORS ICOS CORP (US) 2006-05-03 EP disclosed