SCHEMBL4472787

SCHEMBL4472787

Cc1[nH]c(C)c(-c2ccc(-c3ccc(C(F)(F)F)cc3)nc2)c(=O)c1Br

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.58
KDM1A O60341 1/20 0.39
MAOB P27338 1/20 0.39
KIF11 P52732 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
COMT P21964 1/20 0.38
SLC11A2 P49281 1/20 0.37
RAD51 Q06609 1/20 0.36
DGAT1 O75907 5/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
PDE2A O00408 1/20 0.33
SCN2A Q99250 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
SCHEMBL4483279 0.91 SLC2A1 (0.58) SLC2A1KDM1AKIF11SLC11A2DGAT1
SCHEMBL4493390 0.88 SLC2A1 (0.66) SLC2A1KDM1AMAOBSLC11A2KDM4E
SCHEMBL4464652 0.86 SLC2A1 (0.47) SLC2A1SLC11A2RAD51
SCHEMBL4476390 0.86 SLC2A1 (0.56) SLC2A1DGAT1
SCHEMBL9263676 0.86 SLC2A1 (0.53) SLC2A1KIF11TRPV1COMTSLC11A2
SCHEMBL4565033 0.85 SLC2A1 (0.43) SLC2A1KDM1AMAOBKIF11COMT
SCHEMBL4480432 0.85 SLC2A1 (0.50) SLC2A1DGAT1SCN2A
SCHEMBL4490477 0.85 SLC2A1 (0.48) SLC2A1DGAT1
SCHEMBL4487868 0.84 SLC2A1 (0.45) SLC2A1KDM1AMAOBKDM4EL3MBTL1
SCHEMBL4464122 0.82 SLC2A1 (0.52) SLC2A1TRPV1COMTSLC11A2DGAT1

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
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
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 2278/4885KDM1A 1359/4885MAOB 351/4885

“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.