SCHEMBL6865053

SCHEMBL6865053

COc1ccc(C(C(=O)C(c2ccc(OC)c(OC3CCCC3)c2)c2c(Cl)cncc2Cl)c2c(Cl)cncc2Cl)cc1OC1CCCC1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 18/20 0.59
PDE4D Q08499 9/20 0.59
PDE4B Q07343 7/20 0.59
PDE4C Q08493 7/20 0.59

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
SCHEMBL6858718 0.89 PDE4A (0.57) PDE4APDE4DPDE4BPDE4C
SCHEMBL8290909 0.79 PDE4A (0.54) PDE4APDE4DPDE4BPDE4C
SCHEMBL6865665 0.78 PDE4A (0.55) PDE4APDE4DPDE4BPDE4C
SCHEMBL7387771 0.75 PDE4A (0.54) PDE4APDE4DPDE4BPDE4C
SCHEMBL15790501 0.75 PDE4A (0.52) PDE4APDE4DPDE4BPDE4C
SCHEMBL6755454 0.74 PDE4A (0.69) PDE4APDE4DPDE4BPDE4C
SCHEMBL1028931 0.74 PDE4D (0.74) PDE4APDE4DPDE4BPDE4C
Piclamilast SCHEMBL26573 0.74 PDE4D (1.00) PDE4APDE4DPDE4BPDE4C
SCHEMBL7421935 0.74 PDE4D (0.67) PDE4APDE4DPDE4BPDE4C
SCHEMBL7380336 0.74 PDE4B (0.64) PDE4APDE4DPDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0652868-B1 INHIBITORS OF c-AMP PHOSPHODIESTERASE AVENTIS PHARMA LTD (GB) 2004-11-10 EP claimed
US-5679696-A FOR INHIBITING TUMOR NECROSIS FACTOR; ENZYME INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1997-10-21 US claimed
EP-0652868-B1 INHIBITORS OF c-AMP PHOSPHODIESTERASE AVENTIS PHARMA LTD (GB) 2004-11-10 EP disclosed
EP-0766673-B1 SUBSTITUTED OXIME DERIVATIVES USEFUL AS PDE IV INHIBITORS CELLTECH CHIROSCIENCE LTD (GB) 2002-01-30 EP disclosed
US-6255326-B1 ANTIINFLAMMATORY AGENT; AUTOIMMUNE DISEASES AVENTIS PHARMA LIMITED (GB) 2001-07-03 US disclosed
US-6096768-A ADMINISTERING A 3, 5, 6-SUBSTITUTED PHENYL COMPOUND FOR THE TREATMENT OF INFLAMMATION AND AUTOIMMUNE DISORDERS RHONE-POULENC RORER LIMITED (GB) 2000-08-01 US disclosed
US-5935978-A Compounds containing phenyl linked to aryl or heteroaryl by an aliphatic- or heteroatom-containing linking group RHONE-POULENC RORER LIMITED (GB) 1999-08-10 US disclosed
US-5840724-A COMPOUNDS FOR TUMOR NECROSIS FACTOR OR ENZYME INHIBITORS OF PHOSPHODIESTERASES RHONE-POULENC RORER LIMITED (GB) 1998-11-24 US disclosed
US-5698711-A INHIBITORS OF TUMOR NECROSIS FACTOR, CYCLIC ADENOSINE-3*,5*-MONOPHOSPHATE PHOSPHODIESTERASE AND EOSINOPHILS RHONE-POULENC RORER LIMITED (GB) 1997-12-16 US disclosed
US-5679696-A FOR INHIBITING TUMOR NECROSIS FACTOR; ENZYME INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1997-10-21 US disclosed
EP-0652868-A1 INHIBITORS OF c-AMP PHOSPHODIESTERASE AND TNF RHONE-POULENC RORER LIMITED (GB) 1995-05-17 EP disclosed
WO-1994002465-A1 INHIBITORS OF c-AMP PHOSPHODIESTERASE AND TNF RHONE-POULENC RORER LIMITED (GB) 1994-02-03 WO disclosed