SCHEMBL14734747

SCHEMBL14734747

COc1ccc(-c2ccc3c(c2)CNC3=O)c(OCC(C)(C)C(=O)O[C@@H]2CCOC2)c1OC

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 12/20 0.37
PDE4B Q07343 7/20 0.36
PDE4A P27815 6/20 0.36
PDE4C Q08493 6/20 0.36
GSK3B P49841 1/20 0.35
SYK P43405 2/20 0.34
MTOR P42345 1/20 0.34
POLQ O75417 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
TBK1 Q9UHD2 1/20 0.33

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
SCHEMBL14734820 1.00 PDE4D (0.37) PDE4DPDE4BPDE4APDE4CGSK3B
SCHEMBL2592333 0.95 GSK3B (0.36) PDE4DPDE4BPDE4APDE4CGSK3B
SCHEMBL2589485 0.90 GSK3B (0.38) PDE4DPDE4BPDE4APDE4CGSK3B
SCHEMBL2592192 0.90 GSK3B (0.38) PDE4DPDE4BPDE4APDE4CGSK3B
SCHEMBL2591578 0.89 GSK3B (0.38) PDE4DPDE4BPDE4APDE4CGSK3B
SCHEMBL2584293 0.89 GSK3B (0.38) PDE4DPDE4BPDE4APDE4CGSK3B
SCHEMBL2584334 0.87 PDE4D (0.38) PDE4DPDE4BPDE4APDE4CGPR84
SCHEMBL2591816 0.87 PDE4D (0.38) PDE4DPDE4BPDE4APDE4CGPR84
SCHEMBL14737030 0.86 PDE4D (0.50) PDE4DGPR84
SCHEMBL14734828 0.86 PDE4D (0.50) PDE4DGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2563770-B1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2016-03-23 EP disclosed
US-9051290-B2 Biaryl phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2015-06-09 US disclosed
US-9051290-B2 Biaryl phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2015-06-09 US disclosed
US-9051290-B2 Biaryl phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2015-06-09 US disclosed
US-20130059853-A1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-03-07 US disclosed
US-20130059853-A1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-03-07 US disclosed
US-20130059853-A1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-03-07 US disclosed
EP-2563770-A1 BIARYL PHOSPHODIESTERASE INHIBITORS Leo Pharma A/S (DK) 2013-03-06 EP 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-20130059853-A1 BIARYL PHOSPHODIESTERASE INHIBITORS PDE3B, PDE3A, PDE4A PDE4D 10/4885PDE4B 5/4885PDE4A 3/4885

“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.