SCHEMBL7361900

SCHEMBL7361900

COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2[nH]c(CCCCc3ccccc3)nc12

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 20/20 0.77
PDE4A P27815 19/20 0.77
PDE4B Q07343 19/20 0.77
PDE4C Q08493 19/20 0.77
PDE11A Q9HCR9 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
SCHEMBL1554378 0.95 PDE4D (0.86) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1553933 0.90 PDE4D (0.86) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL7359321 0.89 PDE4D (0.67) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL7359327 0.89 PDE4D (0.64) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1552779 0.85 PDE4D (0.68) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1552882 0.84 PDE4D (0.85) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1553224 0.84 PDE4D (0.70) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1553036 0.84 PDE4D (0.69) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1553303 0.83 PDE4D (0.64) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1553096 0.83 PDE4D (0.64) PDE4DPDE4APDE4BPDE4CPDE11A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934307-A1 SUBSTITUTED AZABICYLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF THE PRODUCTION OF TNF AND CYCLIC AMP PHOSPHODIESTERASE RHONE-POULENC RORER LIMITED (GB) 1999-08-11 EP claimed
WO-1997048697-A1 SUBSTITUTED AZABICYLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF THE PRODUCTION OF TNF AND CYCLIC AMP PHOSPHODIESTERASE RHONE-POULENC RORER LIMITED (GB) 1997-12-24 WO claimed