SCHEMBL8684271

SCHEMBL8684271

COC(=O)c1cccc(-c2ccc(OC)c(OC3CCCC3)c2)c1OC

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 13/20 0.57
PDE4D Q08499 13/20 0.57
PDE4B Q07343 12/20 0.57
PDE4C Q08493 12/20 0.57
PDE5A O76074 3/20 0.57
POLB P06746 1/20 0.48
PDE1A P54750 1/20 0.47
PDE1B Q01064 1/20 0.47
PDE1C Q14123 1/20 0.47
FPR2 P25090 1/20 0.47

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
SCHEMBL8793521 0.82 PDE4A (0.60) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL8465685 0.81 PDE4A (0.65) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL7375824 0.79 PDE4A (0.62) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL8206531 0.79 PDE4A (0.80) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL27364966 0.79 PDE4A (0.65) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL8684350 0.78 PDE4A (0.53) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL8465687 0.78 PDE4A (0.68) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL8483493 0.78 PDE4A (0.65) PDE4APDE4DPDE4BPDE4C
SCHEMBL8683889 0.78 PDE4A (0.60) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL8461881 0.77 PDE4A (0.79) PDE4APDE4DPDE4BPDE4CPDE5A

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
US-5814651-A PHOSPHODIESTERASE TYPE FOUR INHIBITORS PFIZER INC. (US) 1998-09-29 US disclosed