SCHEMBL10185089

SCHEMBL10185089

O=C(NCCNC(=O)c1ccc(C2CC2)c(F)c1)c1ccc(O[C@H]2CC[C@@H](C(=O)O)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 12/20 0.47
SOAT1 P35610 4/20 0.42
HRH3 Q9Y5N1 4/20 0.41
FAAH O00519 1/20 0.41
EPHX2 P34913 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL10186433 0.91 HRH3 (0.42) DGAT1SOAT1HRH3
SCHEMBL10185174 0.90 DGAT1 (0.46) DGAT1HRH3FAAHEPHX2L3MBTL1
SCHEMBL10185081 0.90 DGAT1 (0.42) DGAT1SOAT1HRH3
SCHEMBL10185136 0.89 DGAT1 (0.51) DGAT1SOAT1HRH3FAAHEPHX2
SCHEMBL10184418 0.89 DGAT1 (0.45) DGAT1SOAT1HRH3FAAHEPHX2
SCHEMBL10186185 0.89 CCR3 (0.42) DGAT1SOAT1HRH3SMN1; SMN2
SCHEMBL10186432 0.88 DGAT1 (0.43) DGAT1HRH3EPHX2
SCHEMBL10185357 0.88 DGAT1 (0.43) DGAT1HRH3L3MBTL1ALDH1A1
SCHEMBL10185071 0.87 DGAT1 (0.50) DGAT1SOAT1HRH3FAAHEPHX2
SCHEMBL10186192 0.87 EPHX2 (0.44) DGAT1HRH3FAAHEPHX2L3MBTL1

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 DGAT1 1/4885SOAT1 6/4885HRH3 2422/4885

“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.