SCHEMBL10148245

SCHEMBL10148245

CCOC(=O)[C@H]1CC[C@@H](COc2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 4/20 0.54
PARP10 Q53GL7 4/20 0.54
PARP2 Q9UGN5 2/20 0.54
NR1H4 Q96RI1 1/20 0.49
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
EGFR P00533 2/20 0.47
KMT2A Q03164 2/20 0.47
PKM P14618 1/20 0.47
HTT P42858 1/20 0.47
PLA2G4B P0C869 1/20 0.47
LTA4H P09960 1/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
RAB9A P51151 1/20 0.46
SSTR5 P35346 1/20 0.45
KCNH2 Q12809 1/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL10148247 0.90 PARP15 (0.54) PARP15PARP10PARP2MAPTHPGD
SCHEMBL416244 0.84 PARP15 (0.72) PARP15PARP10PARP2NR1H4PKM
SCHEMBL10184937 0.84 TSHR (0.49) PARP15PARP10PARP2MAPTHPGD
SCHEMBL8016858 0.83 PARP15 (0.62) PARP15PARP10PARP2NR1H4PKM
SCHEMBL8016856 0.83 PARP15 (0.62) PARP15PARP10PARP2NR1H4PKM
SCHEMBL241349 0.82 POLB (0.57) MAPTHPGDEGFRKMT2APKM
SCHEMBL664676 0.82 POLB (0.57) MAPTHPGDEGFRKMT2APKM
SCHEMBL10147939 0.82 POLB (0.57) MAPTHPGDEGFRKMT2APKM
SCHEMBL10186108 0.81 PARP15 (0.48) PARP15PARP10PARP2NR1H4MAPT
SCHEMBL664380 0.81 MEN1 (0.53) KMT2APKMHTTALDH1A1TSHR

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 3 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
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 PARP15 1911/4885PARP10 1704/4885PARP2 3367/4885

“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.