SCHEMBL14736889

SCHEMBL14736889

COc1ccc(-c2cccc3c2COC3=O)c(OCC(C)(C)C(C)C(=O)O)c1OC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 3/20 0.40
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 1/20 0.38
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
MAOB P27338 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KCNJ1 P48048 4/20 0.34
KCNH2 Q12809 3/20 0.34
HPGD P15428 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
SCHEMBL14736863 0.90 PDE4D (0.37) PDE4DKDM4EHSD17B10HDAC4HDAC2
SCHEMBL14737490 0.89 PDE4D (0.36) PDE4DKDM4EHSD17B10HDAC4HDAC2
SCHEMBL14737051 0.89 PDE4D (0.36) PDE4DKDM4EHSD17B10HDAC4HDAC2
SCHEMBL14738302 0.88 PDE4D (0.35) PDE4DKDM4EHSD17B10HDAC4HDAC2
SCHEMBL17599631 0.87 HDAC4 (0.39) PDE4DKDM4EHSD17B10HDAC4HDAC2
SCHEMBL14737811 0.87 PDE4D (0.35) PDE4DKDM4EHSD17B10HDAC4HDAC2
SCHEMBL14737706 0.87 PDE4D (0.35) PDE4DKDM4EHSD17B10HDAC4HDAC2
SCHEMBL14737870 0.86 PDE4D (0.36) PDE4DKDM4EHSD17B10HDAC4HDAC2
SCHEMBL14736928 0.85 PDE4D (0.34) PDE4DKDM4EHSD17B10HDAC4HDAC2
SCHEMBL14737715 0.85 HDAC4 (0.35) PDE4DKDM4EHSD17B10HDAC4HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 10/4885KDM4E 1593/4885HSD17B10 317/4885

“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.