SCHEMBL10184403

SCHEMBL10184403

O=C(NCCNC(=O)c1ccc(O[C@H]2CC[C@@H](C(=O)O)CC2)cc1)c1ccc(OC2CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 7/20 0.54
HRH3 Q9Y5N1 6/20 0.51
L3MBTL1 Q9Y468 1/20 0.49
HSD17B10 Q99714 1/20 0.49
FAAH O00519 1/20 0.47
EPHX2 P34913 1/20 0.47
LMNA P02545 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
OPRM1 P35372 1/20 0.47
OPRD1 P41143 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL10184323 0.96 DGAT1 (0.56) DGAT1HRH3HSD17B10LMNAMEN1
SCHEMBL664113 0.96 DGAT1 (0.56) DGAT1HRH3HSD17B10LMNAMEN1
SCHEMBL664114 0.96 DGAT1 (0.56) DGAT1HRH3HSD17B10LMNAMEN1
SCHEMBL10184898 0.95 DGAT1 (0.52) DGAT1HRH3L3MBTL1HSD17B10FAAH
SCHEMBL663535 0.94 DGAT1 (0.49) DGAT1HRH3FAAHEPHX2KDM4E
SCHEMBL663534 0.94 DGAT1 (0.49) DGAT1HRH3FAAHEPHX2KDM4E
SCHEMBL10186404 0.94 DGAT1 (0.53) DGAT1HRH3FAAHEPHX2ALDH1A1
SCHEMBL10185047 0.94 NPC1 (0.55) DGAT1HRH3L3MBTL1LMNAALDH1A1
SCHEMBL10185044 0.94 LMNA (0.54) DGAT1HRH3L3MBTL1LMNA
SCHEMBL10186133 0.94 DGAT1 (0.49) DGAT1HRH3FAAHEPHX2KDM4E

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 1/4885HRH3 2422/4885L3MBTL1 607/4885

“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.