SCHEMBL10148321

SCHEMBL10148321

COC(=O)C[C@H]1CC[C@@H](Oc2ccc(C(=O)O)c(F)c2F)CC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.37
ACACB O00763 9/20 0.36
PDE4B Q07343 3/20 0.35
PDE4A P27815 2/20 0.35
PDE4C Q08493 2/20 0.35
PDE4D Q08499 2/20 0.35
RORC P51449 1/20 0.34
FABP4 P15090 2/20 0.34
FABP5 Q01469 2/20 0.34

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
SCHEMBL10148325 0.90 ACACB (0.38) FFAR4ACACBRORC
SCHEMBL10186396 0.82 TSHR (0.40) PDE4BPDE4APDE4CPDE4D
SCHEMBL10148305 0.81 SCN9A (0.41) FFAR4FABP4FABP5
SCHEMBL10148298 0.81 LMNA (0.51) FFAR4PDE4BPDE4APDE4CPDE4D
SCHEMBL10148299 0.81 HRH3 (0.45) FFAR4ACACB
SCHEMBL10148229 0.76 TSHR (0.41)
SCHEMBL10148317 0.76 TSHR (0.41)
SCHEMBL10148300 0.76 PDE4D (0.41) FFAR4PDE4BPDE4APDE4CPDE4D
SCHEMBL10148306 0.74 SCN9A (0.41) FFAR4ACACB
SCHEMBL10148308 0.74 EPHX2 (0.53)

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 3 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
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 FFAR4 1053/4885ACACB 210/4885PDE4B 1283/4885

“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.