SCHEMBL6858718

SCHEMBL6858718

COc1ccc(C(C(=O)C(c2ccc(OC)c(OC3CCCC3)c2)c2c(Cl)cccc2Cl)c2c(Cl)cccc2Cl)cc1OC1CCCC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 18/20 0.57
PDE4D Q08499 15/20 0.57
PDE4B Q07343 14/20 0.57
PDE4C Q08493 14/20 0.57
POLB P06746 1/20 0.49

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
SCHEMBL6865053 0.89 PDE4A (0.59) PDE4APDE4DPDE4BPDE4C
SCHEMBL6865402 0.82 PDE4A (0.53) PDE4APDE4DPDE4BPDE4C
SCHEMBL6865413 0.77 PDE4A (0.56) PDE4APDE4DPDE4BPDE4C
SCHEMBL6864582 0.74 PDE4D (0.58) PDE4APDE4DPDE4BPDE4CPOLB
SCHEMBL5610531 0.73 PDE4A (0.59) PDE4APDE4DPDE4BPDE4C
SCHEMBL5047781 0.73 PDE4A (0.56) PDE4APDE4DPDE4BPDE4CPOLB
SCHEMBL13799356 0.73 PDE4A (0.61) PDE4APDE4DPDE4BPDE4C
SCHEMBL8482644 0.73 PDE4A (0.60) PDE4APDE4DPDE4BPDE4C
SCHEMBL7338641 0.73 PDE4D (1.00) PDE4APDE4DPDE4BPDE4C
SCHEMBL6862980 0.73 PDE4B (0.66) 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 10 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
EP-0652868-B1 INHIBITORS OF c-AMP PHOSPHODIESTERASE AVENTIS PHARMA LTD (GB) 2004-11-10 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