SCHEMBL4296927

SCHEMBL4296927

CC(C)(C)[Si](C)(C)OC1CC(CN2C(=O)c3ccccc3C2=O)CN(C(=O)O)C1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KEAP1 Q14145 2/20 0.35
HSD17B10 Q99714 1/20 0.34
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
ACHE P22303 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MAPK1 P28482 1/20 0.33
MAPT P10636 1/20 0.33
RECQL P46063 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
SCHEMBL4298164 0.83 TP53 (0.39) TP53KDM4EALDH1A1TDP1KEAP1
SCHEMBL21272035 0.82 KDM4E (0.36) TP53KDM4EALDH1A1TDP1KEAP1
SCHEMBL4294393 0.82 KDM4E (0.36) TP53KDM4EALDH1A1TDP1KEAP1
SCHEMBL21271883 0.82 KDM4E (0.36) TP53KDM4EALDH1A1TDP1KEAP1
SCHEMBL3841839 0.77 NR1H2 (0.38)
SCHEMBL4298180 0.76 PPM1D (0.33)
SCHEMBL4043389 0.76 CA12 (0.43) TP53KDM4EALDH1A1TDP1KEAP1
SCHEMBL2692884 0.76 CHRNA7 (0.45) ACHEKMT2AMEN1
SCHEMBL29985450 0.76 ABCB1 (0.38) TP53KMT2AMEN1
SCHEMBL21286395 0.76 ABCB1 (0.38) TP53KMT2AMEN1

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
EP-2044077-B1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES GLAXO GROUP LTD (GB) 2016-10-05 EP disclosed
US-8071592-B2 Derivatives and analogs of N-ethylquinolones and N-ethylazaquinolones GLAXO GROUP LIMITED (GB) 2011-12-06 US disclosed
US-20090270374-A1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES GLAXO GROUP LIMITED (GB) 2009-10-29 US disclosed
EP-1992628-A1 Derivatives and analogs of N-ethylquinolones and N-ethylazaquinolones GLAXO GROUP LIMITED (GB) 2008-11-19 EP 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-20090270374-A1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES ETFA, NQO2, GNAQ TP53 1940/4885KDM4E 2078/4885ALDH1A1 3885/4885

“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.