SCHEMBL13652967

SCHEMBL13652967

COc1ccc(C(=O)Nc2c(Cl)cnc(Cl)c2Cl)cc1OC1CCCC1

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 16/20 0.78
▸ PDE4A P27815 10/20 0.78
▸ PDE4B Q07343 10/20 0.78
▸ PDE4C Q08493 10/20 0.78
▸ PDE5A O76074 4/20 0.56
▸ PDE1A P54750 2/20 0.56
▸ PDE1B Q01064 2/20 0.56
▸ PDE1C Q14123 2/20 0.56

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
SCHEMBL13524375 0.91 PDE4D (0.76) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL13652966 0.89 PDE4D (0.72) PDE4DPDE4APDE4BPDE4CPDE5A
Piclamilast SCHEMBL26573 0.88 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7335911 0.87 PDE4D (0.98) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7332164 0.85 PDE4D (0.74) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL14456041 0.84 PDE4D (0.88) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7359687 0.83 PDE4D (0.86) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7335169 0.83 PDE4D (0.83) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7338641 0.83 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7334025 0.82 PDE4D (0.82) PDE4DPDE4APDE4BPDE4CPDE5A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS CANNIZZARO CARINA 2009-10-01 — — US disclosed
US-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS CANNIZZARO CARINA 2009-10-01 — — US disclosed
US-7432261-B2 Anti-inflammatory phosphonate compounds GILEAD SCIENCES, INC. (US) 2008-10-07 — — US disclosed
US-7432261-B2 Anti-inflammatory phosphonate compounds GILEAD SCIENCES, INC. (US) 2008-10-07 — — 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-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS PHOSPHO1, TNF, PTGES PDE4D 1243/4885PDE4A 432/4885PDE4B 530/4885

“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.

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