SCHEMBL10185136

SCHEMBL10185136

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

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 10/20 0.51
SOAT1 P35610 3/20 0.51
CHRM1 P11229 1/20 0.48
AR P10275 2/20 0.46
HRH3 Q9Y5N1 4/20 0.43
FAAH O00519 1/20 0.43
EPHX2 P34913 1/20 0.43
ABL1 P00519 1/20 0.43
BCR P11274 1/20 0.43

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
SCHEMBL10185071 0.91 DGAT1 (0.50) DGAT1SOAT1HRH3FAAHEPHX2
SCHEMBL10185429 0.90 DGAT1 (0.48) DGAT1SOAT1CHRM1HRH3FAAH
SCHEMBL10185043 0.90 DGAT1 (0.48) DGAT1SOAT1HRH3FAAHEPHX2
SCHEMBL10185034 0.90 DGAT1 (0.48) DGAT1SOAT1ARHRH3
SCHEMBL10185089 0.89 DGAT1 (0.47) DGAT1SOAT1HRH3FAAHEPHX2
SCHEMBL10184403 0.89 DGAT1 (0.54) DGAT1HRH3FAAHEPHX2
SCHEMBL13117516 0.88 DGAT1 (0.47) DGAT1SOAT1ARFAAHEPHX2
SCHEMBL10186414 0.88 MEN1 (0.50) DGAT1SOAT1EPHX2
SCHEMBL10185063 0.88 EPHX2 (0.48) DGAT1SOAT1FAAHEPHX2
SCHEMBL10186404 0.88 DGAT1 (0.53) DGAT1SOAT1HRH3FAAHEPHX2

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 6/4885CHRM1 2527/4885

“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.