SCHEMBL10185165

SCHEMBL10185165

N#Cc1ccc(Oc2ccc(C(=O)NCCNC(=O)c3ccc(O[C@H]4CC[C@@H](C(=O)O)CC4)cc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 7/20 0.52
SOAT1 P35610 1/20 0.52
DPP4 P27487 3/20 0.45
AR P10275 1/20 0.44
EPHX2 P34913 3/20 0.43
PARP15 Q460N3 1/20 0.43
PARP10 Q53GL7 1/20 0.43
PARP2 Q9UGN5 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MMP2 P08253 1/20 0.43
CA9 Q16790 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
PRKAA2 P54646 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL10185122 0.88 CA12 (0.56) DGAT1CA12CA1CA2MMP2
SCHEMBL10184403 0.87 DGAT1 (0.54) DGAT1EPHX2HRH3
SCHEMBL10185270 0.85 MMP13 (0.57) DGAT1CA12CA1CA2MMP2
SCHEMBL10184332 0.85 DGAT1 (0.51) DGAT1SOAT1EPHX2CA12CA1
SCHEMBL10185610 0.85 MAPK14 (0.60) DGAT1
SCHEMBL10186147 0.84 NPC1 (0.54) DGAT1CA12CA1CA2MMP2
SCHEMBL664114 0.84 DGAT1 (0.56) DGAT1NPC1RAB9AHRH3
SCHEMBL664113 0.84 DGAT1 (0.56) DGAT1NPC1RAB9AHRH3
SCHEMBL10184323 0.84 DGAT1 (0.56) DGAT1NPC1RAB9AHRH3
SCHEMBL28011385 0.83 DGAT1 (0.59) DGAT1SOAT1EPHX2HRH3

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 6/4885DPP4 123/4885

“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.