SCHEMBL7357205

SCHEMBL7357205

COc1ccc(C(=O)Nc2c(Cl)cccc2Cl)cc1OC1CC2CCC1O2

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 14/20 0.66
PDE4A P27815 9/20 0.66
PDE4B Q07343 9/20 0.66
PDE4C Q08493 9/20 0.66
PDE5A O76074 1/20 0.45
PDE1A P54750 1/20 0.45
PDE1B Q01064 1/20 0.45
PDE1C Q14123 1/20 0.45
CYP2B6 P20813 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL7361572 0.91 PDE4D (0.68) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL7356302 0.83 PDE4D (0.63) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7363109 0.82 PDE4D (0.42) PDE4DPDE4APDE4BPDE4C
SCHEMBL8553907 0.80 CA12 (0.52) PDE4DPDE4APDE4BPDE4C
SCHEMBL7338641 0.79 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7357173 0.79 PDE4B (0.62) PDE4DPDE4APDE4BPDE4C
SCHEMBL7353445 0.78 PDE4D (0.52) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL7360234 0.77 PDE4D (0.76) PDE4DPDE4APDE4BPDE4C
SCHEMBL7361951 0.76 PDE4D (0.64) PDE4DPDE4APDE4BPDE4C
SCHEMBL7334555 0.74 PDE4D (0.88) PDE4DPDE4APDE4BPDE4CPDE5A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0741707-B1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE POULENC RORER LTD (GB) 1998-04-01 EP claimed
EP-0741707-A1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1996-11-13 EP claimed
WO-1995020578-A1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1995-08-03 WO claimed
EP-0741707-B1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE POULENC RORER LTD (GB) 1998-04-01 EP disclosed
EP-0741707-A1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1996-11-13 EP disclosed
WO-1995020578-A1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1995-08-03 WO disclosed