SCHEMBL13129294

SCHEMBL13129294

CCCCCCCCCCCCCCCCNC(=O)CCC(=O)OCC

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.65
NAAA Q02083 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.60
FAAH O00519 4/20 0.56
GAA P10253 1/20 0.54
EPHX1 P07099 5/20 0.50
MAPT P10636 1/20 0.50
DNM1 Q05193 1/20 0.50
EPHX2 P34913 3/20 0.49
SLC6A5 Q9Y345 1/20 0.48

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
SCHEMBL8630173 0.92 L3MBTL1 (0.67) CASP2NAAAL3MBTL1FAAHGAA
SCHEMBL23280900 0.92 L3MBTL1 (0.67) CASP2NAAAL3MBTL1FAAHGAA
SCHEMBL27753495 0.88 L3MBTL1 (0.62) CASP2NAAAL3MBTL1FAAHGAA
SCHEMBL2616415 0.87 CASP2 (0.66) CASP2NAAAL3MBTL1FAAHEPHX1
SCHEMBL2583169 0.86 NAAA (0.59) CASP2NAAAL3MBTL1FAAHGAA
SCHEMBL13129293 0.86 CASP2 (0.69) CASP2NAAAL3MBTL1FAAHEPHX1
SCHEMBL4093621 0.86 CASP2 (0.69) CASP2NAAAL3MBTL1FAAHEPHX1
SCHEMBL22211254 0.85 CASP2 (0.87) CASP2NAAAFAAHEPHX1DNM1
SCHEMBL7887680 0.85 CASP2 (0.87) CASP2NAAAFAAHEPHX1DNM1
SCHEMBL13700142 0.85 CASP2 (0.87) CASP2NAAAFAAHEPHX1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9770442-B2 Self-assembling amphiphilic polymers as anti-cancer agents ALLEXCEL INC. (US) 2017-09-26 US disclosed
US-20100239659-A1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTI-CANCER AGENTS ALLEXCEL., INC. (US) 2010-09-23 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-20100239659-A1 SELF-ASSEMBLING AMPHIPHILIC POLYMERS AS ANTI-CANCER AGENTS CD44, EPCAM, EGFR CASP2 3257/4885NAAA 1109/4885L3MBTL1 2147/4885

“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.