SCHEMBL6841883

SCHEMBL6841883

COc1ccc(C2=NN(Cc3ccc(NC(=O)OCCCN4CCCC4)cc3)C(=O)CC2)cc1OC(C)C

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 3/20 0.52
PDE4B Q07343 12/20 0.51
PDE4A P27815 2/20 0.51
PDE4C Q08493 2/20 0.51
PDE3B Q13370 2/20 0.51
PDE3A Q14432 2/20 0.51
MET P08581 1/20 0.45
LMNA P02545 1/20 0.42

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
SCHEMBL6841665 0.95 PDE4D (0.53) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6841887 0.94 PDE4D (0.59) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6842649 0.94 PDE4D (0.50) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6842719 0.94 PDE4D (0.50) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6841837 0.94 PDE4D (0.62) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6843973 0.90 PDE4D (0.53) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6843974 0.90 PDE4D (0.52) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6674812 0.89 PDE4D (0.55) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6841767 0.89 PDE4D (0.60) PDE4DPDE4BPDE4APDE4CPDE3B
SCHEMBL6842355 0.89 PDE4D (0.51) PDE4DPDE4BPDE4APDE4CPDE3B

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-20040235845-A1 Use of phosphodiesterase iv inhibitors MERCK PATENT GESSELSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2004-11-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040235845-A1 Use of phosphodiesterase iv inhibitors PDE4A, PDE3A, PDE3B PDE4D 12/4885PDE4B 4/4885PDE4A 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.