SCHEMBL13337074

SCHEMBL13337074

CNC(=O)C(C)NC(=O)C(C)NC(=O)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
MMP1 P03956 1/20 0.33
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
MME P08473 1/20 0.31
ACE P12821 1/20 0.31
CPA1 P15085 1/20 0.31
ACE2 Q9BYF1 1/20 0.31
MMP9 P14780 3/20 0.31
MMP8 P22894 3/20 0.31
CNR2 P34972 1/20 0.31
FFAR2 O15552 1/20 0.31
MMP2 P08253 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL21638038 0.97 GAA (0.34) GAAMMP1KMT2AMEN1ALDH1A1
SCHEMBL25139840 0.97 GAA (0.34) GAAMMP1KMT2AMEN1ALDH1A1
SCHEMBL13857144 0.86
SCHEMBL14076482 0.85 XIAP (0.38) MMP1MMEACECPA1ACE2
SCHEMBL13402108 0.85 XIAP (0.38) MMP1MMEACECPA1ACE2
SCHEMBL21153239 0.85 XIAP (0.38) MMP1MMEACECPA1ACE2
SCHEMBL13038892 0.84 MME (0.35) MMP1MMEACECPA1ACE2
SCHEMBL13038895 0.83 KMT2A (0.31) KMT2A
SCHEMBL16317288 0.83 ALDH1A1 (0.34) MMP1ALDH1A1MAPTMMEACE
SCHEMBL24933411 0.83 ALDH1A1 (0.34) MMP1ALDH1A1MAPTMMEACE

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-20100130581-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF PAIN THE UNIVERSITY OF QUEENSLAND 2010-05-27 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-20100130581-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF PAIN OPRL1, CRH, OPRK1 GAA 1482/4885MMP1 3090/4885KMT2A 3776/4885

“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.