SCHEMBL4471107

SCHEMBL4471107

Cc1[nH]c(C)c(-c2ccc(-c3cccc(OC(F)(F)F)c3)nc2)c(=O)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.45
KCNH2 Q12809 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.42
DYRK1A Q13627 8/20 0.40
FYN P06241 2/20 0.40
SLC2A1 P11166 1/20 0.40
NPY5R Q15761 1/20 0.39
CTSA P10619 1/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2B Q13224 2/20 0.38
P2RX7 Q99572 1/20 0.37
DHODH Q02127 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
SCHEMBL4490712 0.88 SLC2A1 (0.40) KCNH2SCN10ASLC2A1
Hydrochloric Acid SCHEMBL4489660 0.87 DGAT1 (0.39) KCNH2SCN10ASLC2A1
SCHEMBL4492018 0.84 SLC2A1 (0.51) XDHSLC2A1GRIN1GRIN2BDHODH
SCHEMBL4490539 0.82 KDM1A (0.41) SLC2A1NPY5RGRIN1GRIN2B
SCHEMBL4491157 0.80 RORC (0.40) SLC2A1CTSADHODH
SCHEMBL13754687 0.80 HPGDS (0.43) SLC2A1DHODH
SCHEMBL9266167 0.80 SLC2A1 (0.51) XDHSLC2A1
SCHEMBL13049774 0.79 DGAT1 (0.40) KCNH2SCN10A
SCHEMBL4471113 0.79 XDH (0.40) XDHKCNH2SCN10ANPY5RCTSA
SCHEMBL4473339 0.78 SLC2A1 (0.41) KCNH2SCN10ASLC2A1NPY5R

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 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-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 XDH 198/4885KCNH2 1502/4885SCN10A 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.