SCHEMBL5733281

SCHEMBL5733281

COCCOc1cc(C(=O)N[C@@H]2CCCC[C@@H]2c2ccc(OC)c(OC)c2)ccc1OC

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.49
TAS1R1 Q7RTX1 3/20 0.49
PDE4A P27815 3/20 0.47
PDE4B Q07343 3/20 0.47
PDE4C Q08493 3/20 0.47
PDE4D Q08499 3/20 0.47
MEN1 O00255 1/20 0.47
ALPL P05186 1/20 0.47
KMT2A Q03164 1/20 0.47
SMPD1 P17405 5/20 0.47
CNR2 P34972 1/20 0.46
REN P00797 3/20 0.45
TP53 P04637 1/20 0.45
F10 P00742 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 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
SCHEMBL5733276 1.00 TAS1R3 (0.49) TAS1R3TAS1R1PDE4APDE4BPDE4C
SCHEMBL5734886 0.89 PDE4B (0.54) TAS1R3TAS1R1PDE4APDE4BPDE4C
SCHEMBL5736521 0.86 SMPD1 (0.59) PDE4APDE4BPDE4CPDE4DMEN1
SCHEMBL5734935 0.85 PDE4D (0.58) PDE4APDE4BPDE4CPDE4D
SCHEMBL5735485 0.84 PDE4B (0.52) TAS1R3TAS1R1PDE4APDE4BPDE4C
SCHEMBL5735482 0.84 PDE4B (0.52) TAS1R3TAS1R1PDE4APDE4BPDE4C
SCHEMBL5736544 0.84 PDE4D (0.57) PDE4APDE4BPDE4CPDE4D
SCHEMBL5736549 0.84 PDE4D (0.57) PDE4APDE4BPDE4CPDE4D
SCHEMBL7204083 0.84 TAS1R3 (0.51) TAS1R3TAS1R1PDE4APDE4BPDE4C
SCHEMBL5737318 0.84 TAS1R3 (0.51) TAS1R3TAS1R1PDE4APDE4BPDE4C

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