SCHEMBL4479166

SCHEMBL4479166

Cc1[nH]c(C)c(-c2c[nH]c(-c3ccc(C#N)cc3)cc2=O)c(=O)c1Br

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYMP P19971 1/20 0.34
SLC2A1 P11166 1/20 0.34
CCNB2 O95067 1/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
CCNB3 Q8WWL7 1/20 0.32
SLC11A2 P49281 1/20 0.32
DAO P14920 2/20 0.32
CSF1R P07333 1/20 0.31
KIT P10721 1/20 0.31
FLT3 P36888 1/20 0.31
KDM1A O60341 1/20 0.31
ATM Q13315 2/20 0.31
CHEK1 O14757 1/20 0.31
GCGR P47871 1/20 0.31
MAPK14 Q16539 1/20 0.31

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
SCHEMBL4490476 0.85 SLC2A1 (0.38) SLC2A1GSK3BCDK5ALDH1A1
SCHEMBL4464654 0.84 ADORA2A (0.39) SLC2A1GSK3BALDH1A1
SCHEMBL4487870 0.84 SLC2A1 (0.40) SLC2A1GCGRMAPK14ALDH1A1
SCHEMBL4487288 0.82 PTGS2 (0.39) SLC2A1MAPK14
SCHEMBL4472791 0.81 SLC2A1 (0.46) SLC2A1CCNB2CDK1CCNB1GSK3A
SCHEMBL4475903 0.80 CTSV (0.46) SLC2A1
SCHEMBL4480435 0.79 SLC2A1 (0.40) SLC2A1DAO
SCHEMBL4484311 0.78 BRD4 (0.38) SLC2A1
SCHEMBL4475945 0.77 MAPT (0.35) SLC2A1
SCHEMBL4483281 0.77 SLC2A1 (0.44) 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 4 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-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 TYMP 68/4885SLC2A1 2278/4885CCNB2 644/4885

“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.