SCHEMBL7362470

SCHEMBL7362470

COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)cc1O[C@H]1CCOC1

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 19/20 0.76
PDE4A P27815 14/20 0.76
PDE4B Q07343 14/20 0.76
PDE4C Q08493 14/20 0.76
CYP2B6 P20813 1/20 0.56
ABCB11 O95342 1/20 0.51

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
SCHEMBL7354074 1.00 PDE4D (0.76) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL7361858 1.00 PDE4D (0.76) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL7354173 0.94 PDE4D (0.83) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL7355815 0.94 PDE4D (0.67) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL7362092 0.90 PDE4D (0.63) PDE4DPDE4APDE4BPDE4C
SCHEMBL7360234 0.90 PDE4D (0.76) PDE4DPDE4APDE4BPDE4C
SCHEMBL7357453 0.89 PDE4D (0.60) PDE4DPDE4APDE4BPDE4C
SCHEMBL7361143 0.89 PDE4D (0.62) PDE4DPDE4APDE4BPDE4C
SCHEMBL7353807 0.89 PDE4D (0.62) PDE4DPDE4APDE4BPDE4C
SCHEMBL7356144 0.89 PDE4D (0.66) PDE4DPDE4APDE4BPDE4CABCB11

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