SCHEMBL10186504

SCHEMBL10186504

O=C(NCCNC(=O)N1CCC(Oc2ccc(F)cc2)CC1)c1ccc(O[C@H]2CC[C@@H](C(=O)O)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.52
LMNA P02545 2/20 0.51
KDM4E B2RXH2 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
CYP2C19 P33261 1/20 0.49
HRH3 Q9Y5N1 3/20 0.47
DGAT1 O75907 2/20 0.47
MAPT P10636 1/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2J2 P51589 1/20 0.46
OPRM1 P35372 2/20 0.46
OPRD1 P41143 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL10186297 0.93 SMN1; SMN2 (0.49) EPHX2LMNAKDM4EL3MBTL1CYP2C19
SCHEMBL10186461 0.92 LMNA (0.52) EPHX2LMNAKDM4EL3MBTL1HRH3
SCHEMBL10185085 0.92 LMNA (0.50) EPHX2LMNAKDM4EL3MBTL1HRH3
SCHEMBL10186404 0.90 DGAT1 (0.53) EPHX2HRH3DGAT1ALDH1A1
SCHEMBL10184515 0.90 EPHX2 (0.48) EPHX2LMNAKDM4EL3MBTL1HRH3
SCHEMBL10185006 0.90 EPHX2 (0.56) EPHX2LMNAKDM4EL3MBTL1HRH3
SCHEMBL10185355 0.89 L3MBTL1 (0.52) EPHX2LMNAKDM4EL3MBTL1HRH3
SCHEMBL10185216 0.89 L3MBTL1 (0.51) EPHX2LMNAKDM4EL3MBTL1HRH3
SCHEMBL10186258 0.88 L3MBTL1 (0.48) EPHX2LMNAKDM4EL3MBTL1HRH3
SCHEMBL10186219 0.88 EPHX2 (0.52) EPHX2LMNAKDM4EL3MBTL1CYP2C9

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 EPHX2 1718/4885LMNA 2889/4885KDM4E 3060/4885

“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.