SCHEMBL2593218

SCHEMBL2593218

CCOc1c(OC)ccc(-c2cccc3c2COC3=O)c1OCC(=O)OC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 6/20 0.39
ALDH1A1 P00352 3/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.34
GSK3A P49840 1/20 0.34
TSHR P16473 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
GLA P06280 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KCNJ1 P48048 1/20 0.33
FPR2 P25090 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 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
SCHEMBL14750940 0.98 PDE4D (0.39) PDE4DALDH1A1HPGDRAB9AGSK3A
SCHEMBL14737114 0.93 PDE4D (0.41) PDE4DALDH1A1RAB9ATSHRKDM4E
SCHEMBL14737513 0.92 PDE4D (0.41) PDE4DALDH1A1HPGDRAB9AKDM4E
SCHEMBL17613865 0.89 ALDH1A1 (0.33) PDE4DALDH1A1HPGDRAB9AKDM4E
SCHEMBL2592853 0.88 PDE4D (0.38) PDE4DALDH1A1HPGDGSK3ATSHR
SCHEMBL2589059 0.88 KMT2A (0.40) PDE4DALDH1A1HPGDKDM4EMAPT
SCHEMBL2591761 0.86 PDE4D (0.37) PDE4DALDH1A1HPGDKDM4ENPSR1
SCHEMBL2585631 0.86 PDE4D (0.38) PDE4DALDH1A1HPGDKDM4ENPSR1
SCHEMBL2592059 0.86 ALDH1A1 (0.43) PDE4DALDH1A1HPGDRAB9ATSHR
SCHEMBL2591338 0.85 PDE4D (0.37) PDE4DALDH1A1HPGDTSHRKDM4E

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 10/4885ALDH1A1 824/4885HPGD 1088/4885

“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.