SCHEMBL4472794

SCHEMBL4472794

CCCCCCCCCc1cnc([Sn](CCCC)(CCCC)CCCC)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.44
RAB9A P51151 4/20 0.42
MAPT P10636 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
NPC1 O15118 2/20 0.42
STAT3 P40763 1/20 0.42
ATM Q13315 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
PTGS2 P35354 4/20 0.39
ESR1 P03372 2/20 0.39
ADRA2A P08913 2/20 0.39

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
SCHEMBL5719734 0.83 L3MBTL1 (0.32) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL22748284 0.78 RAB9A (0.49) RARBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL17584302 0.76
SCHEMBL12186163 0.75 RARB (0.50) RARBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL12186156 0.75 RARB (0.50) RARBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL28055917 0.75 RARB (0.50) RARBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL7508556 0.73 RARB (0.49) RARBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL5748785 0.73 RAB9A (0.53) RARBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL9850844 0.73 MAPT (0.54) RARBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL7839207 0.73 RARB (0.49) RARBRAB9AMAPTSMN1; SMN2NPC1

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 RARB 2930/4885RAB9A 2000/4885MAPT 1942/4885

“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.