SCHEMBL13323652

SCHEMBL13323652

COC(=O)C(=O)CN1C(=O)C=CC1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 3/20 0.52
GSK3B P49841 3/20 0.52
ALDH1A1 P00352 3/20 0.44
BLM P54132 2/20 0.44
HPGD P15428 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
WRN Q14191 1/20 0.44
HIF1A Q16665 1/20 0.44
MGLL Q99685 7/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
GMNN O75496 1/20 0.41
THPO P40225 1/20 0.41
PMP22 Q01453 1/20 0.41
FAAH O00519 4/20 0.37
AKT1 P31749 1/20 0.37
HSP90AA1 P07900 1/20 0.35
TLR9 Q9NR96 1/20 0.35

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
SCHEMBL8365539 0.81 GSK3A (0.49) GSK3AGSK3BALDH1A1BLMHPGD
SCHEMBL5163732 0.79 GSK3A (0.66) GSK3AGSK3BALDH1A1BLMHPGD
SCHEMBL1103799 0.77 GSK3A (0.52) GSK3AGSK3BALDH1A1BLMHPGD
SCHEMBL877582 0.74 CA12 (0.58) ALDH1A1LMNAMAPTNPSR1PKM
SCHEMBL1103791 0.74 GSK3A (0.48) GSK3AGSK3BALDH1A1BLMHPGD
SCHEMBL12291174 0.72 GSK3A (0.52) GSK3AGSK3BALDH1A1BLMHPGD
SCHEMBL18101913 0.72 GSK3A (0.47) GSK3AGSK3BALDH1A1BLMHPGD
SCHEMBL11955666 0.72 GSK3A (0.55) GSK3AGSK3BALDH1A1BLMHPGD
SCHEMBL437306 0.71 GSK3A (0.50) GSK3AGSK3BALDH1A1BLMHPGD
SCHEMBL29995038 0.70 GSK3A (0.48) GSK3AGSK3BALDH1A1BLMHPGD

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-20100113643-A1 CURATIVES FOR EPOXY ADHESIVE COMPOSITIONS DESIGNER MOLECULES, INC. (US) 2010-05-06 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-20100113643-A1 CURATIVES FOR EPOXY ADHESIVE COMPOSITIONS ALOX5, LTC4S, ALOX15B GSK3A 4857/4885GSK3B 4874/4885ALDH1A1 144/4885

“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.