SCHEMBL5735938

SCHEMBL5735938

COc1ccc(C2CCCCC2NC(=O)c2ccc(NC(C)=O)c(OCC3CC3)c2)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.46
PDE4A P27815 4/20 0.46
PDE4C Q08493 4/20 0.46
PDE4D Q08499 4/20 0.46
BRD4 O60885 4/20 0.43
TAS1R3 Q7RTX0 3/20 0.43
TAS1R1 Q7RTX1 3/20 0.43
MEN1 O00255 1/20 0.41
ALPL P05186 1/20 0.41
KMT2A Q03164 1/20 0.41
CNR1 P21554 1/20 0.41
PDE5A O76074 1/20 0.40
PDE1A P54750 1/20 0.40
PDE1B Q01064 1/20 0.40
PDE1C Q14123 1/20 0.40

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
SCHEMBL5735944 1.00 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DBRD4
SCHEMBL5734886 0.91 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DTAS1R3
SCHEMBL5735485 0.86 PDE4B (0.52) PDE4BPDE4APDE4CPDE4DTAS1R3
SCHEMBL5735482 0.86 PDE4B (0.52) PDE4BPDE4APDE4CPDE4DTAS1R3
SCHEMBL5734199 0.85 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DTAS1R3
SCHEMBL6167359 0.85 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DTAS1R3
SCHEMBL5734204 0.85 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DTAS1R3
SCHEMBL6167355 0.85 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DTAS1R3
SCHEMBL5733988 0.84 PDE4B (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL5733984 0.84 PDE4B (0.62) 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 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