SCHEMBL10186146

SCHEMBL10186146

O=C(NCCNC(=O)c1ccc(OCC2CC2)c(Cl)c1)c1ccc(O[C@H]2CC[C@@H](C(=O)O)CC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 5/20 0.45
PDE4B Q07343 5/20 0.45
PDE4C Q08493 5/20 0.45
PDE4D Q08499 5/20 0.45
PTGDR2 Q9Y5Y4 8/20 0.45
DGAT1 O75907 7/20 0.41

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
SCHEMBL10184345 0.96 PTGDR2 (0.44) PDE4APDE4BPDE4CPDE4DPTGDR2
SCHEMBL10184974 0.92 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DPTGDR2
SCHEMBL10184875 0.90 POLB (0.48) PTGDR2DGAT1
SCHEMBL10184349 0.90 PDE4A (0.40) PDE4APDE4BPDE4CPDE4DPTGDR2
SCHEMBL10186431 0.89 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DDGAT1
SCHEMBL10184967 0.89 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DDGAT1
SCHEMBL10185076 0.89 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DDGAT1
SCHEMBL10184334 0.88 PTGDR2 (0.46) PDE4APDE4BPDE4CPDE4DPTGDR2
SCHEMBL10184318 0.87 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DPTGDR2
SCHEMBL10186143 0.87 DGAT1 (0.42) PDE4APDE4BPDE4CPDE4DPTGDR2

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-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-23 US disclosed
WO-2010122968-A1 DIACYLETHYLENEDIAMINE COMPOUND アステラス製薬株式会社 (JP) 2010-10-28 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-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND DGAT1, DGAT2, DIMT1 PDE4A 1520/4885PDE4B 1283/4885PDE4C 1933/4885

“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.