SCHEMBL4478658

SCHEMBL4478658

Cc1cc(=O)c(-c2ccc(-c3ccc(OC(F)(F)F)cc3)nc2)c(C)[nH]1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 1/20 0.40
PSD A5PKW4 1/20 0.40
SCN10A Q9Y5Y9 8/20 0.39
KCNH2 Q12809 3/20 0.39
SCN5A Q14524 2/20 0.39
SCN1A P35498 1/20 0.39
SCN9A Q15858 1/20 0.39
SCN2A Q99250 1/20 0.39
SCN8A Q9UQD0 1/20 0.39
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
DGAT1 O75907 2/20 0.37
CHRM5 P08912 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
NOTUM Q6P988 1/20 0.36

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
SCHEMBL13049074 0.86 SCN10A (0.39) MAT2ASCN10AKCNH2SCN2ADGAT1
SCHEMBL13761994 0.84 MAPT (0.43) SCN2A
SCHEMBL4488899 0.83 SLC2A1 (0.48) SCN10AKCNH2SCN5ASCN1ASCN9A
SCHEMBL9262847 0.83 PTGS2 (0.44) PSDSCN10AKCNH2SCN5ASCN1A
SCHEMBL13754678 0.81 HPGDS (0.48) DGAT1
SCHEMBL4480432 0.81 SLC2A1 (0.50) MAT2APSDSCN10AKCNH2SCN5A
SCHEMBL4490712 0.81 SLC2A1 (0.40) MAT2APSDSCN10AKCNH2SCN5A
Hydrochloric Acid SCHEMBL4489660 0.80 DGAT1 (0.39) MAT2APSDSCN10AKCNH2SCN5A
SCHEMBL4485182 0.79 PTGS2 (0.44) MAT2APSDSCN10ASCN5ACHRM5
SCHEMBL4486775 0.78 SLC2A1 (0.46) SCN2A

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-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 MAT2A 2066/4885PSD 3924/4885SCN10A 3578/4885

“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.