SCHEMBL7360862

SCHEMBL7360862

COc1ccc(C#N)cc1OC1CCOC1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.54
PDE4B Q07343 12/20 0.54
PDE4A P27815 9/20 0.54
PDE4C Q08493 9/20 0.54
CHEK1 O14757 2/20 0.53

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
SCHEMBL7358404 0.86 PDE4D (0.57) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL523941 0.86 PDE4D (0.52) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL12391607 0.85 CHEK1 (0.45) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL12391611 0.85 CHEK1 (0.45) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL17622119 0.82 CHEK1 (0.45) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL17616923 0.82 CHEK1 (0.45) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL1965826 0.82 TRPC6 (0.44) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL3747459 0.82 TRPC6 (0.44) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL1962810 0.82 TRPC6 (0.44) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL4940189 0.81 PDE4A (0.55) PDE4DPDE4BPDE4APDE4C

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