SCHEMBL8556672

SCHEMBL8556672

COc1ccc(Oc2ccc(OC)c(OC3CCOC3)c2Cc2c(Cl)cccc2Cl)c(Cc2c(Cl)cccc2Cl)c1OC1CCOC1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 17/20 0.56
PDE4A P27815 14/20 0.56
PDE4B Q07343 12/20 0.56
PDE4C Q08493 12/20 0.56
SLC5A1 P13866 1/20 0.39
SLC5A2 P31639 1/20 0.39

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
SCHEMBL7353005 0.75 PDE4D (0.48) PDE4DPDE4APDE4BPDE4C
SCHEMBL7357381 0.73 PDE4D (0.67) PDE4DPDE4APDE4BPDE4C
SCHEMBL7352641 0.73 PDE4D (0.67) PDE4DPDE4APDE4BPDE4C
SCHEMBL6589467 0.72 PDE4B (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL6584467 0.70 PDE4B (0.78) PDE4DPDE4APDE4BPDE4C
SCHEMBL7361766 0.69 CYP1A1 (0.47) PDE4DPDE4APDE4BPDE4C
SCHEMBL7361769 0.69 CYP1A1 (0.47) PDE4DPDE4APDE4BPDE4C
SCHEMBL14804191 0.69 SLC6A4 (0.53) PDE4DPDE4APDE4BPDE4C
SCHEMBL6588075 0.68 PDE4D (0.68) PDE4DPDE4APDE4BPDE4C
SCHEMBL12180595 0.67 PDE4D (0.58) PDE4DPDE4APDE4BPDE4C

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 1 patent. 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