SCHEMBL3101104

SCHEMBL3101104

CCOC(=O)CCC(F)C(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
KMT2A Q03164 2/20 0.50
POLB P06746 2/20 0.50
CYP1A2 P05177 1/20 0.45
GAA P10253 2/20 0.44
MGAM O43451 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
ALDH1A1 P00352 7/20 0.41
TRPA1 O75762 1/20 0.41
NR1I2 O75469 1/20 0.37
PGR P06401 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
PTGS2 P35354 1/20 0.37
PDE4D Q08499 1/20 0.37
HSD17B10 Q99714 3/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL3100949 0.84 CYP1A2 (0.47) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL8057740 0.83 GABRP (0.45) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL15536758 0.83 L3MBTL1 (0.52) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL11531078 0.80 ALDH1A1 (0.42) L3MBTL1KMT2APOLBGAAMGAM
SCHEMBL29242517 0.80 ALDH1A1 (0.42) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL28456840 0.79 L3MBTL1 (0.49) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL6650291 0.78 L3MBTL1 (0.56) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL13890084 0.78 L3MBTL1 (0.56) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL256644 0.78 L3MBTL1 (0.47) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL22122792 0.78 L3MBTL1 (0.47) L3MBTL1KMT2APOLBCYP1A2GAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8470836-B2 Dipeptidyl peptidase-IV inhibiting compounds, methods of preparing the same, and pharmaceutical compositions containing the same as active agent LG LIFE SCIENCES, LTD. (KR) 2013-06-25 US disclosed
US-20100274013-A1 DIPEPTIDYL PEPTIDASE-IV INHIBITING COMPOUNDS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS ACTIVE AGENT LG LIFE SCIENCES, LTD. (KR) 2010-10-28 US disclosed
EP-2220086-A2 DIPEPTIDYL PEPTIDASE-IV INHIBITING COMPOUNDS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS ACTIVE AGENT LG Life Sciences Ltd. (KR) 2010-08-25 EP disclosed
WO-2009082134-A2 DIPEPTIDYL PEPTIDASE-IV INHIBITING COMPOUNDS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS ACTIVE AGENT LG LIFE SCIENCES, LTD. (KR) 2009-07-02 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-20100274013-A1 DIPEPTIDYL PEPTIDASE-IV INHIBITING COMPOUNDS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS ACTIVE AGENT DPP4, DPP7, DPP9 L3MBTL1 4458/4885KMT2A 3788/4885POLB 4449/4885

“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.