SCHEMBL7249554

SCHEMBL7249554

COc1ccc(/C(=C/C#N)c2ccncc2)cc1OC.COc1ccc(/C(=C/C#N)c2ccncc2)cc1OC

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.80
PDE4B Q07343 20/20 0.80
PDE4C Q08493 20/20 0.80
PDE4D Q08499 20/20 0.80

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
SCHEMBL7249557 1.00 PDE4A (0.80) PDE4APDE4BPDE4CPDE4D
SCHEMBL4824714 1.00 PDE4A (0.80) PDE4APDE4BPDE4CPDE4D
SCHEMBL8164843 1.00 PDE4A (0.80) PDE4APDE4BPDE4CPDE4D
SCHEMBL4824723 1.00 PDE4A (0.80) PDE4APDE4BPDE4CPDE4D
Acrylonitrile SCHEMBL27703171 0.95 PDE4A (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL4823516 0.90 PDE4A (0.83) PDE4APDE4BPDE4CPDE4D
SCHEMBL4823519 0.90 PDE4A (0.83) PDE4APDE4BPDE4CPDE4D
SCHEMBL825369 0.89 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL4826823 0.86 PDE4A (0.59) PDE4APDE4BPDE4CPDE4D
SCHEMBL4816903 0.85 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D

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-20030045726-A1 Novel immunotherapeutic agents MULLER GEORGE W (US) 2003-03-06 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-20030045726-A1 Novel immunotherapeutic agents NFKBIA, RELA, IKBKG PDE4A 22/4885PDE4B 33/4885PDE4C 39/4885

“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.