SCHEMBL4470755

SCHEMBL4470755

CC(C(=O)CC(=O)O)c1cccc(C(=O)c2ccccc2)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.69
PTGS2 P35354 5/20 0.69
MAPT P10636 5/20 0.69
SMN1; SMN2 Q16637 3/20 0.69
ALDH1A1 P00352 3/20 0.69
LMNA P02545 3/20 0.69
CXCR1 P25024 2/20 0.69
CXCR2 P25025 2/20 0.69
CYP3A4 P08684 2/20 0.69
RECQL P46063 1/20 0.69
KDM4E B2RXH2 1/20 0.69
HPGD P15428 1/20 0.69
MAPK1 P28482 1/20 0.69
PMP22 Q01453 1/20 0.69
SLC22A6 Q4U2R8 1/20 0.69
HSD17B10 Q99714 1/20 0.69
CXCL8 P10145 1/20 0.69
THPO P40225 1/20 0.69
HIF1A Q16665 1/20 0.69
HTT P42858 3/20 0.58

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
SCHEMBL4470465 1.00 PTGS1 (0.69) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1
SCHEMBL4470462 1.00 PTGS1 (0.69) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1
SCHEMBL4482250 0.87 PTGS1 (0.70) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1
SCHEMBL13179862 0.86 PTGS1 (0.71) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1
SCHEMBL16746716 0.86 PTGS1 (0.71) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1
SCHEMBL31113389 0.86 PTGS1 (0.71) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1
SCHEMBL11850160 0.85 PTGS1 (0.69) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1
SCHEMBL4480248 0.84 PTGS1 (0.65) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1
SCHEMBL4472608 0.84 PTGS1 (0.65) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1
SCHEMBL5960828 0.82 ALDH1A1 (0.54) PTGS1PTGS2MAPTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1581474-A1 CHIRAL ARYLKETONES IN THE TREATEMENT OF NEUTROPHIL-DEPENDENT INFLAMMATORY DESEASES Dompé S.P.A. (IT) 2005-10-05 EP claimed
WO-2004052830-A1 CHIRAL ARYLKETONES IN THE TREATEMENT OF NEUTROPHIL-DEPENDENT INFLAMMATORY DESEASES DOMPE S.P.A. (IT) 2004-06-24 WO claimed
US-9328057-B2 Chiral arylketones in the treatment of neutrophil-dependent inflammatory diseases DOMPE' FARMACEUTICI S.P.A. (IT) 2016-05-03 US disclosed
US-20090203652-A1 CHIRAL ARYLKETONES IN THE TREATMENT OF NEUTROPHIL-DEPENDENT INFLAMMATORY DISEASES DOMPE PHA.R.MA S.P.A. (IT) 2009-08-13 US disclosed
EP-1581474-B1 CHIRAL ARYLKETONES IN THE TREATEMENT OF NEUTROPHIL-DEPENDENT INFLAMMATORY DESEASES DOMPE SPA (IT) 2008-08-27 EP disclosed
US-20060247297-A1 Chiral arylketones in the treatment of neutrophil-dependent inflammatory diseases DOMPE PHA.R.MA S.P.A. (IT) 2006-11-02 US disclosed
EP-1581474-A1 CHIRAL ARYLKETONES IN THE TREATEMENT OF NEUTROPHIL-DEPENDENT INFLAMMATORY DESEASES Dompé S.P.A. (IT) 2005-10-05 EP disclosed
WO-2004052830-A1 CHIRAL ARYLKETONES IN THE TREATEMENT OF NEUTROPHIL-DEPENDENT INFLAMMATORY DESEASES DOMPE S.P.A. (IT) 2004-06-24 WO 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 (2 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-20060247297-A1 Chiral arylketones in the treatment of neutrophil-dependent inflammatory diseases NR1H4, MMP8, NR1I2 PTGS1 664/4885PTGS2 803/4885MAPT 1794/4885
US-20090203652-A1 CHIRAL ARYLKETONES IN THE TREATMENT OF NEUTROPHIL-DEPENDENT INFLAMMATORY DISEASES NR1H4, MMP8, NR1I2 PTGS1 664/4885PTGS2 803/4885MAPT 1794/4885

“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.