SCHEMBL4448611

SCHEMBL4448611

CCOc1cc(C2CNC(=O)C(Cc3ccc(F)cc3)C2)ccc1OC

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 17/20 0.57
PDE4D Q08499 13/20 0.54
PDE4B Q07343 11/20 0.47
PDE4C Q08493 11/20 0.47
BCHE P06276 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
SCHEMBL2799305 1.00 PDE4A (0.57) PDE4APDE4DPDE4BPDE4CBCHE
SCHEMBL2799239 1.00 PDE4A (0.57) PDE4APDE4DPDE4BPDE4CBCHE
SCHEMBL2801940 0.90 PDE4D (0.61) PDE4APDE4DPDE4BPDE4C
SCHEMBL2798678 0.90 PDE4D (0.61) PDE4APDE4DPDE4BPDE4C
SCHEMBL4442028 0.90 PDE4D (0.61) PDE4APDE4DPDE4BPDE4C
SCHEMBL2800190 0.89 PDE4A (0.54) PDE4APDE4DPDE4BPDE4C
SCHEMBL2800202 0.87 PDE4D (0.54) PDE4APDE4DPDE4BPDE4C
SCHEMBL2798274 0.87 PDE4D (0.54) PDE4APDE4DPDE4BPDE4C
SCHEMBL4449911 0.87 PDE4D (0.54) PDE4APDE4DPDE4BPDE4C
SCHEMBL2797304 0.85 PDE4D (0.74) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137150-A1 PIPERIDINONES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2009-12-30 EP disclosed
WO-2008110794-A1 PIPERIDINONES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-09-18 WO disclosed