SCHEMBL8558459

SCHEMBL8558459

COCC(C)Oc1cc(C(=O)Cc2c(Cl)cncc2Cl)cnc1SC

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 16/20 0.49
PDE4A P27815 4/20 0.37
PDE4B Q07343 3/20 0.37
PDE4C Q08493 2/20 0.37
GCK P35557 1/20 0.34

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
SCHEMBL70307 0.88 PDE4D (0.51) PDE4DPDE4APDE4BPDE4C
SCHEMBL8558466 0.84 PDE4D (0.50) PDE4DPDE4APDE4BPDE4C
SCHEMBL7356087 0.83 PDE4B (0.48) PDE4DPDE4APDE4BPDE4CGCK
SCHEMBL7356316 0.78 PDE4D (0.60) PDE4DPDE4APDE4BPDE4C
SCHEMBL6858726 0.71 PDE4D (0.60) PDE4DPDE4APDE4BPDE4C
SCHEMBL7340773 0.70 PDE4D (0.76) PDE4DPDE4APDE4BPDE4C
SCHEMBL7390353 0.69 PDE4D (0.51) PDE4DPDE4APDE4BPDE4C
SCHEMBL7357327 0.69 PDE4D (0.56) PDE4DPDE4APDE4BPDE4C
SCHEMBL6858838 0.68 PDE4D (0.81) PDE4DPDE4APDE4BPDE4C
SCHEMBL7356090 0.67 PDE4D (0.49) 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 2 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 claimed
EP-0741707-B1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE POULENC RORER LTD (GB) 1998-04-01 EP disclosed