SCHEMBL4483751

SCHEMBL4483751

Cc1[nH]c(C)c(-c2ccc(C#Cc3ccc(C(F)(F)F)cc3)nc2)c(=O)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGES O14684 4/20 0.48
SLC2A1 P11166 1/20 0.39
ACACB O00763 2/20 0.35
PTGES2 Q9H7Z7 1/20 0.35
COMT P21964 1/20 0.34
SLC11A2 P49281 1/20 0.34
MCHR1 Q99705 5/20 0.33
DGAT1 O75907 1/20 0.33
RARB P10826 1/20 0.32

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
SCHEMBL4464122 0.87 SLC2A1 (0.52) PTGESSLC2A1ACACBPTGES2COMT
SCHEMBL13754688 0.85 PTGES (0.44) PTGESACACB
SCHEMBL4565033 0.82 SLC2A1 (0.43) SLC2A1COMTSLC11A2DGAT1
SCHEMBL4470825 0.82 PTGES (0.44) PTGESSLC2A1ACACBPTGES2COMT
SCHEMBL4492260 0.81 SLC2A1 (0.41) SLC2A1COMTSLC11A2
SCHEMBL4470810 0.78 SLC2A1 (0.39) SLC2A1COMTSLC11A2
SCHEMBL4480629 0.77 DAO (0.44) SLC2A1COMTSLC11A2
SCHEMBL4475703 0.77 PTGES (0.35) PTGESSLC2A1ACACB
SCHEMBL4490726 0.76 SLC2A1 (0.61) PTGESSLC2A1DGAT1
SCHEMBL4491220 0.74 SLC2A1 (0.43) SLC2A1DGAT1

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-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
EP-1858876-A2 PYRIDINONE DERIVATIVES AGAINST MALARIA GLAXO GROUP LIMITED (GB) 2007-11-28 EP disclosed
WO-2006094799-A2 PYRIDINONE DERIVATIVES AGAINST MALARIA GLAXO GROUP LIMITED (GB) 2006-09-14 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 (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 PTGES 842/4885SLC2A1 2278/4885ACACB 2776/4885

“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.