SCHEMBL2585852

SCHEMBL2585852

COc1ccc(-c2ccc3c(c2)COC3=O)c(OCC(=O)OCC2CCC2)c1OC

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 12/20 0.43
ABCG2 Q9UNQ0 3/20 0.41
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
PRF1 P14222 2/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
POLQ O75417 1/20 0.38
IMPDH2 P12268 1/20 0.38

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
SCHEMBL2591371 0.96 PDE4D (0.43) PDE4DABCG2PRF1PDE4APDE4B
SCHEMBL2585714 0.94 PRF1 (0.42) PDE4DABCG2MAOAMAOBPRF1
SCHEMBL17613985 0.91 PRF1 (0.40) PDE4DABCG2MAOAMAOBPRF1
SCHEMBL2588346 0.90 PRF1 (0.44) PDE4DABCG2PRF1PDE4APDE4B
SCHEMBL2592221 0.89 PDE4D (0.47) PDE4DMAOAMAOBPRF1POLQ
SCHEMBL2592566 0.88 PDE4D (0.51) PDE4DABCG2PRF1IMPDH2
SCHEMBL2587910 0.87 PDE4D (0.49) PDE4DABCG2PRF1PDE4APDE4B
SCHEMBL14737012 0.87 PRF1 (0.46) PDE4DABCG2PRF1PDE4APDE4B
SCHEMBL2581805 0.86 PDE4D (0.51) PDE4DABCG2PRF1IMPDH2
SCHEMBL2592788 0.86 PDE4D (0.41) PDE4DABCG2MAOAMAOBPRF1

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 9 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
WO-2011134468-A1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2011-11-03 WO 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 10/4885ABCG2 1085/4885MAOA 191/4885

“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.