SCHEMBL4666708

SCHEMBL4666708

CC(Cc1ccc(Cl)cc1)C(=O)C1=C(O)C(CCc2ccccc2)OC1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 3/20 0.38
CDC25A P30304 1/20 0.38
CDC25B P30305 1/20 0.38
PPARG P37231 3/20 0.35
PPARA Q07869 3/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 2/20 0.35
NPY5R Q15761 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PSMB8 P28062 1/20 0.34
PSMB5 P28074 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
NAAA Q02083 2/20 0.34

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
SCHEMBL4666713 1.00 DUSP3 (0.38) DUSP3CDC25ACDC25BPPARGPPARA
SCHEMBL4666711 1.00 DUSP3 (0.38) DUSP3CDC25ACDC25BPPARGPPARA
SCHEMBL4666668 0.87 ALDH1A1 (0.39) ALDH1A1LMNAMAPTTSHRMEN1
SCHEMBL4666669 0.87 ALDH1A1 (0.39) ALDH1A1LMNAMAPTTSHRMEN1
SCHEMBL4666671 0.87 ALDH1A1 (0.39) ALDH1A1LMNAMAPTTSHRMEN1
SCHEMBL4662955 0.84 DUSP3 (0.41) DUSP3CDC25ACDC25BPPARGPPARA
SCHEMBL4664864 0.83 TSHR (0.38) DUSP3CDC25ACDC25BALDH1A1TSHR
SCHEMBL4666679 0.81 NAAA (0.39) ALDH1A1MAPTKMT2ANAAA
SCHEMBL4663052 0.80 ALDH1A1 (0.39) DUSP3CDC25ACDC25BALDH1A1TSHR
SCHEMBL4665123 0.80 ALDH1A1 (0.37) DUSP3CDC25ACDC25BPPARGPPARA

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
US-20080132562-A1 TETRONIC AND TETRAMIC ACIDS GODEL THIERRY 2008-06-05 US claimed
US-20050119329-A1 Tetronic and tetramic acids HOFFMANN-LA ROCHE INC. 2005-06-02 US claimed
US-20080132562-A1 TETRONIC AND TETRAMIC ACIDS GODEL THIERRY 2008-06-05 US disclosed
EP-1689729-A1 TETRONIC AND TETRAMIC ACIDS AS INHIBITORS OF BETA-SECREASE F. Hoffmann-La Roche AG (CH) 2006-08-16 EP disclosed
WO-2005058857-A1 TETRONIC AND TETRAMIC ACIDS AS INHIBITORS OF BETA-SECREASE F. HOFFMANN-LA ROCHE AG (CH) 2005-06-30 WO disclosed
US-20050119329-A1 Tetronic and tetramic acids HOFFMANN-LA ROCHE INC. 2005-06-02 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 (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-20080132562-A1 TETRONIC AND TETRAMIC ACIDS BACE1, PSEN1, BACE2 DUSP3 3878/4885CDC25A 2484/4885CDC25B 3121/4885
US-20050119329-A1 Tetronic and tetramic acids BACE1, PSEN1, BACE2 DUSP3 3878/4885CDC25A 2484/4885CDC25B 3121/4885

“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.