SCHEMBL13611401

SCHEMBL13611401

CC(=O)NCC(CO)NC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.39
NFKB1 P19838 1/20 0.39
PTGS2 P35354 1/20 0.39
THPO P40225 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.38
CRAT P43155 1/20 0.37
MAPK1 P28482 1/20 0.36
HIF1A Q16665 1/20 0.36
TGFBR1 P36897 1/20 0.35
MTNR1B P49286 5/20 0.34
MTNR1A P48039 4/20 0.34
PLA2G2C Q5R387 2/20 0.34
PCNA P12004 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL1861994 0.83
SCHEMBL16254581 0.82 MAPT (0.37) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL13411268 0.82 CA12 (0.39) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL292766 0.77 CRAT (0.34) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL26659178 0.77 MTNR1A (0.35) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL292767 0.77 CRAT (0.34) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL16254559 0.77 EPHX1 (0.49) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL5669163 0.76
SCHEMBL14970377 0.76
SCHEMBL48989 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 US 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-20090286791-A1 Amide Compounds DLAT, DGAT2, DGAT1 KDM4E 2891/4885MAPT 1448/4885THRB 1774/4885

“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.