SCHEMBL4489336

SCHEMBL4489336

Cc1[nH]c(C)c(-c2ccc(-c3ccccc3C(F)(F)F)nc2)c(=O)c1Br

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.52
MAPKAPK2 P49137 1/20 0.38
TRPA1 O75762 3/20 0.37
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
HSD11B1 P28845 3/20 0.35
PDE10A Q9Y233 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
NPY5R Q15761 1/20 0.34
KMO O15229 2/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
SCN9A Q15858 1/20 0.34
TGFBR1 P36897 1/20 0.34
METAP2 P50579 1/20 0.34
NOTUM Q6P988 1/20 0.33

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
SCHEMBL4564903 0.87 SLC2A1 (0.39) SLC2A1MAPKAPK2TRPA1ALOX5APFEN1
SCHEMBL4476390 0.86 SLC2A1 (0.56) SLC2A1ALOX5APFEN1
SCHEMBL4486512 0.85 SLC2A1 (0.47) SLC2A1MAPKAPK2ALOX5APFEN1
SCHEMBL4488013 0.83 SLC2A1 (0.45) SLC2A1MAPKAPK2HSD11B1
SCHEMBL4472787 0.81 SLC2A1 (0.58) SLC2A1
SCHEMBL4490477 0.81 SLC2A1 (0.48) SLC2A1
SCHEMBL4483279 0.80 SLC2A1 (0.58) SLC2A1ALOX5APFEN1
SCHEMBL4493390 0.79 SLC2A1 (0.66) SLC2A1CYP1A2CYP3A4NPY5R
SCHEMBL4483841 0.78 SLC2A1 (0.67) SLC2A1ALOX5AP
SCHEMBL4464652 0.77 SLC2A1 (0.47) SLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7579353-B2 Pyridinone derivatives against malaria GLAXO GROUP LIMITED (GB) 2009-08-25 US claimed
US-20080287461-A1 Pyridinone Derivatives Against Malaria GLAXO GROUP LIMITED (GB) 2008-11-20 US claimed
EP-1858876-A2 PYRIDINONE DERIVATIVES AGAINST MALARIA GLAXO GROUP LIMITED (GB) 2007-11-28 EP claimed
WO-2006094799-A2 PYRIDINONE DERIVATIVES AGAINST MALARIA GLAXO GROUP LIMITED (GB) 2006-09-14 WO claimed
US-7579353-B2 Pyridinone derivatives against malaria GLAXO GROUP LIMITED (GB) 2009-08-25 US disclosed
US-7579353-B2 Pyridinone derivatives against malaria GLAXO GROUP LIMITED (GB) 2009-08-25 US disclosed
US-7579353-B2 Pyridinone derivatives against malaria GLAXO GROUP LIMITED (GB) 2009-08-25 US disclosed
US-20080287461-A1 Pyridinone Derivatives Against Malaria GLAXO GROUP LIMITED (GB) 2008-11-20 US disclosed
US-20080287461-A1 Pyridinone Derivatives Against Malaria GLAXO GROUP LIMITED (GB) 2008-11-20 US disclosed
US-20080287461-A1 Pyridinone Derivatives Against Malaria GLAXO GROUP LIMITED (GB) 2008-11-20 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-20080287461-A1 Pyridinone Derivatives Against Malaria G6PD, PNPO, PLPBP SLC2A1 2278/4885MAPKAPK2 1614/4885TRPA1 3367/4885

“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.