SCHEMBL14737451

SCHEMBL14737451

COc1ccc(-c2ccc3c(c2)COC3=O)c(OCCOC(=O)CC(F)(F)F)c1OC

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 12/20 0.41
PRF1 P14222 3/20 0.41
NR3C1 P04150 1/20 0.39
PGR P06401 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
ABCG2 Q9UNQ0 2/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
IMPDH2 P12268 1/20 0.37

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
SCHEMBL2587716 0.92 PDE4D (0.42) PDE4DPRF1NR3C1PGRPDE4A
SCHEMBL2588170 0.89 PDE4D (0.45) PDE4DPRF1PDE4APDE4BPDE4C
SCHEMBL2589091 0.87 PDE4D (0.46) PDE4DPRF1PDE4APDE4BPDE4C
SCHEMBL2586070 0.87 PDE4D (0.44) PDE4DPRF1PDE4APDE4BPDE4C
SCHEMBL2594467 0.86 PDE4D (0.46) PDE4DPRF1PDE4APDE4BPDE4C
SCHEMBL2583975 0.86 PDE4D (0.41) PDE4DPRF1NR3C1PGRPDE4A
SCHEMBL2591030 0.85 PDE4D (0.47) PDE4DPRF1PDE4APDE4BPDE4C
SCHEMBL2592290 0.85 MAOB (0.42) PDE4DKDM4E
SCHEMBL2591814 0.85 PDE4D (0.44) PDE4DPRF1PDE4APDE4BPDE4C
SCHEMBL2591507 0.85 PDE4D (0.41) PDE4DPRF1PDE4APDE4BPDE4C

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 7 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

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 10/4885PRF1 3550/4885NR3C1 1334/4885

“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.