SCHEMBL5162227

SCHEMBL5162227

CCOC(=O)CCCN1C(=O)C=CC1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.64
GSK3B P49841 1/20 0.64
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2C19 P33261 1/20 0.51
BLM P54132 1/20 0.51
WRN Q14191 1/20 0.51
HIF1A Q16665 1/20 0.51
PTGS1 P23219 7/20 0.50
PTGS2 P35354 7/20 0.50
MGLL Q99685 4/20 0.50
FAAH O00519 3/20 0.50
HSP90AA1 P07900 1/20 0.48
TLR9 Q9NR96 1/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
PKM P14618 1/20 0.48
XBP1 P17861 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
SCHEMBL5165588 0.93 PTGS1 (0.60) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL5165278 0.93 PTGS1 (0.60) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL5165325 0.89 GSK3A (0.68) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL5164273 0.87 MAPT (0.58) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL5160668 0.85 MAPK1 (0.59) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL5166261 0.84 PTGS1 (0.57) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL15024126 0.83 CYP3A4 (0.49) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL15024044 0.83 PTGS1 (0.60) PTGS1PTGS2MGLLFAAHLMNA
SCHEMBL15024067 0.83 PTGS1 (0.60) PTGS1PTGS2MGLLFAAHLMNA
SCHEMBL5161619 0.82 MGLL (0.54) GSK3AGSK3BALDH1A1HPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1582548-B1 PROCESS FOR PRODUCING POLYMERIZABLE POLYBRANCHED POLYESTER DAINIPPON INK & CHEMICALS (JP) 2007-03-28 EP disclosed
CN-1303130-C Process for producing polymerizable polybranched polyester DAINIPPON INK & CHEMICALS (JP) 2007-03-07 CN disclosed
US-7141642-B2 Process for producing polymerizable polybranched polyester DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-11-28 US disclosed
US-20060047140-A1 Process for producing polymerizable polybranched polyester DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-03-02 US disclosed
CN-1714113-A Process for producing polymerizable polybranched polyester DAINIPPON INK & CHEMICALS (JP) 2005-12-28 CN disclosed
EP-1582548-A1 PROCESS FOR PRODUCING POLYMERIZABLE POLYBRANCHED POLYESTER DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-05 EP 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-20060047140-A1 Process for producing polymerizable polybranched polyester ACSL4, ACSL1, HACL2 GSK3A 2879/4885GSK3B 3375/4885ALDH1A1 1751/4885

“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.