SCHEMBL5734935

SCHEMBL5734935

COc1ccc([C@H]2CCCC[C@H]2NC(=O)c2ccc(OC)c(OC3CCCC3)c2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.58
PDE4A P27815 13/20 0.58
PDE4B Q07343 13/20 0.58
PDE4C Q08493 13/20 0.58
PDE5A O76074 3/20 0.56
PDE1A P54750 1/20 0.54
PDE1B Q01064 1/20 0.54
PDE1C Q14123 1/20 0.54

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
SCHEMBL5736544 0.99 PDE4D (0.57) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL5736549 0.99 PDE4D (0.57) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL5567651 0.85 POLB (0.51)
SCHEMBL7204083 0.85 TAS1R3 (0.51) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL5053376 0.85 TAS1R3 (0.51) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL5737318 0.85 TAS1R3 (0.51) PDE4DPDE4APDE4BPDE4C
SCHEMBL5567648 0.85 POLB (0.51)
SCHEMBL5733281 0.85 TAS1R3 (0.49) PDE4DPDE4APDE4BPDE4C
SCHEMBL5733276 0.85 TAS1R3 (0.49) PDE4DPDE4APDE4BPDE4C
SCHEMBL7402512 0.84 MCHR1 (0.52) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1650193-A2 6-Phenylphenanthridines with PDE-IV inhibiting activity ALTANA Pharma AG (DE) 2006-04-26 EP disclosed
EP-1147089-B1 PHENYLPHENANTHRIDINES WITH PDE-IV INHIBITING ACTIVITY ALTANA PHARMA AG (DE) 2005-12-07 EP disclosed
US-6476025-B1 Phenylphennanthridines with PDE-IV inhibiting activity ALTANA PHARMA AG (DE) 2002-11-05 US disclosed
EP-1147089-A1 PHENYLPHENANTHRIDINES WITH PDE-IV INHIBITING ACTIVITY Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2001-10-24 EP disclosed
WO-2000042020-A1 PHENYLPHENANTHRIDINES WITH PDE-IV INHIBITING ACTIVITY BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-07-20 WO disclosed