SCHEMBL10148313

SCHEMBL10148313

CCOC(=O)CC1CCN(c2cc(F)c(C(=O)O)cc2F)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
ALDH1A1 P00352 5/20 0.46
HTT P42858 3/20 0.46
FFAR4 Q5NUL3 4/20 0.44
LMNA P02545 3/20 0.44
MAPK1 P28482 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
GPR174 Q9BXC1 1/20 0.42
ITGB3 P05106 5/20 0.41
ITGA2B P08514 5/20 0.41
TSHR P16473 2/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL10148314 0.91 ALDH1A1 (0.55) MAPTALDH1A1HTTFFAR4LMNA
SCHEMBL10148330 0.83 L3MBTL1 (0.54) MAPTALDH1A1LMNAMAPK1ITGB3
SCHEMBL30350660 0.81 L3MBTL1 (0.46) MAPTALDH1A1HTTFFAR4LMNA
SCHEMBL19510704 0.81 L3MBTL1 (0.46) MAPTALDH1A1HTTFFAR4LMNA
SCHEMBL31467876 0.80 PTPN1 (0.47) MAPTALDH1A1HTTFFAR4LMNA
SCHEMBL10148315 0.79 FFAR4 (0.50) FFAR4
SCHEMBL10148332 0.78 L3MBTL1 (0.66) MAPTALDH1A1LMNAMAPK1TSHR
SCHEMBL25035144 0.77 L3MBTL1 (0.45) MAPTALDH1A1FFAR4LMNAMAPK1
SCHEMBL31334246 0.76 MAPT (0.61) MAPTALDH1A1HTTLMNAMAPK1
SCHEMBL19511081 0.75 FFAR4 (0.48) FFAR4

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 MAPT 2628/4885ALDH1A1 963/4885HTT 922/4885

“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.