SCHEMBL7361935

SCHEMBL7361935

CCCCCOc1cc(C(=O)Nc2c(Cl)cncc2Cl)ccc1OC

nearest known ligand 0.94

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.94
PDE4D Q08499 8/20 0.94
PDE4A P27815 3/20 0.94
PDE4C Q08493 3/20 0.94
CYP2B6 P20813 1/20 0.70
SMPD1 P17405 5/20 0.63
CNR2 P34972 2/20 0.58

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
SCHEMBL7339491 0.99 PDE4B (0.92) PDE4BPDE4DPDE4APDE4CCYP2B6
SCHEMBL7334333 0.99 PDE4B (0.92) PDE4BPDE4DPDE4APDE4CCYP2B6
SCHEMBL7336155 0.97 PDE4B (1.00) PDE4BPDE4DPDE4APDE4CCYP2B6
SCHEMBL7357159 0.93 PDE4B (0.92) PDE4BPDE4DPDE4APDE4CCYP2B6
SCHEMBL6878175 0.91 PDE4B (0.85) PDE4BPDE4DPDE4APDE4CCYP2B6
SCHEMBL9524615 0.90 PDE4B (0.77) PDE4BPDE4DPDE4APDE4CCYP2B6
SCHEMBL7362694 0.89 PDE4B (0.82) PDE4BPDE4DPDE4APDE4CCYP2B6
SCHEMBL6877187 0.89 PDE4B (0.82) PDE4BPDE4DPDE4APDE4CCYP2B6
SCHEMBL985307 0.89 PDE4B (0.82) PDE4BPDE4DPDE4APDE4CCYP2B6
SCHEMBL987384 0.88 PDE4B (0.80) PDE4BPDE4DPDE4APDE4CCYP2B6

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 3 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 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