SCHEMBL14737422

SCHEMBL14737422

COc1ccc(-c2cccc3c2COC3=O)c(OCC2(CCCCC(=O)O)CC2)c1OC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IMPDH1 P20839 7/20 0.38
FFAR4 Q5NUL3 1/20 0.38
PDE4D Q08499 3/20 0.36
HDAC4 P56524 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
MAOB P27338 2/20 0.33
KDM4E B2RXH2 3/20 0.33
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
LTB4R Q15722 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL14736896 0.99 IMPDH1 (0.39) IMPDH1FFAR4PDE4DHDAC4HDAC2
SCHEMBL14738069 0.97 FFAR4 (0.39) IMPDH1FFAR4PDE4DHDAC4HDAC2
SCHEMBL14737212 0.94 PDE4D (0.37) IMPDH1FFAR4PDE4DHDAC4HDAC2
SCHEMBL14737352 0.88 PDE4D (0.38) FFAR4PDE4DHDAC4HDAC2HDAC8
SCHEMBL14736919 0.85 PDE4D (0.37) PDE4DHDAC4HDAC2HDAC8MAOB
SCHEMBL14737333 0.85 PDE4D (0.39) PDE4DHDAC4HDAC2HDAC8MAOB
SCHEMBL14736961 0.83 PDE4D (0.36) PDE4DHDAC4HDAC2HDAC8MAOB
SCHEMBL14737357 0.83 PDE4D (0.39) PDE4DHDAC4HDAC2HDAC8MAOB
SCHEMBL14737378 0.83 PDE4D (0.40) PDE4DHDAC4HDAC2HDAC8MAOB
SCHEMBL14734749 0.82 PDE4D (0.39) PDE4DHDAC4HDAC2HDAC8MAOB

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 IMPDH1 286/4885FFAR4 1858/4885PDE4D 10/4885

“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.