SCHEMBL2199973

SCHEMBL2199973

CCCCCC1C(=O)N(C)C(=O)N(C)C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.49
KDM4A O75164 2/20 0.49
KDM4C Q9H3R0 2/20 0.49
USP2 O75604 1/20 0.49
POLB P06746 1/20 0.49
ALOX15 P16050 1/20 0.49
ALDH1A1 P00352 10/20 0.40
MAPT P10636 9/20 0.40
HSD17B10 Q99714 5/20 0.40
GAA P10253 5/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
THRB P10828 2/20 0.40
RECQL P46063 1/20 0.40
TP53 P04637 2/20 0.39
HPGD P15428 4/20 0.39
KDM4E B2RXH2 3/20 0.39
PTGS1 P23219 4/20 0.38
CYP3A4 P08684 2/20 0.38
CYP1A2 P05177 2/20 0.38

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
SCHEMBL1263039 0.94 L3MBTL1 (0.50) L3MBTL1KDM4AKDM4CUSP2POLB
SCHEMBL21694442 0.76 ALDH1A1 (0.45) L3MBTL1KDM4AKDM4CUSP2POLB
SCHEMBL1263716 0.75 ALDH1A1 (0.46) L3MBTL1KDM4AKDM4CUSP2POLB
SCHEMBL31681885 0.73 SMN1; SMN2 (0.43) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL17717920 0.72 KDM4A (0.35) L3MBTL1KDM4AKDM4CUSP2POLB
SCHEMBL17717929 0.72 MAPT (0.47) L3MBTL1KDM4AKDM4CUSP2POLB
SCHEMBL1426468 0.71 ELANE (0.48) L3MBTL1KDM4AKDM4CUSP2POLB
SCHEMBL7674510 0.71 PDE4A (0.42) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL9007459 0.71 ALDH1A1 (0.55) L3MBTL1KDM4AKDM4CUSP2POLB
SCHEMBL7887401 0.70 PTGS1 (0.42) ALDH1A1GAATHRBTP53PTGS1

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8222381-B2 Derivatives of monosaccharides for drug discovery ALCHEMIA LIMITED (AU) 2012-07-17 US claimed
US-20060167237-A1 Derivatives of monosaccharides for drug discovery ALCHEMIA LIMITED (AU) 2006-07-27 US claimed
EP-1539780-A1 DERIVATIVES OF MONOSACCHARIDES FOR DRUG DISCOVERY Alchemia Limited (AU) 2005-06-15 EP claimed
WO-2004014929-A1 DERIVATIVES OF MONOSACCHARIDES FOR DRUG DISCOVERY ALCHEMIA LIMITED (AU) 2004-02-19 WO claimed
US-9709571-B2 Method of drug design VAST BIOSCIENCE PTY LIMITED (AU) 2017-07-18 US disclosed
US-20130172210-A1 METHOD OF DRUG DESIGN ALCHEMIA LIMITED (AU) 2013-07-04 US disclosed
US-8426345-B2 Method of drug design ALCHEMIA LIMITED (AU) 2013-04-23 US disclosed
EP-2545923-A1 Antibacterial agents Alchemia Limited (AU) 2013-01-16 EP disclosed
EP-1934388-B1 METHOD OF DRUG DESIGN ALCHEMIA LTD (AU) 2012-12-05 EP disclosed
US-8222381-B2 Derivatives of monosaccharides for drug discovery ALCHEMIA LIMITED (AU) 2012-07-17 US disclosed
US-7989422-B2 Antibacterial agents ALCHEMIA LIMITED (AU) 2011-08-02 US disclosed
US-20110165700-A1 CLASSES OF COMPOUNDS THAT INTERACT WITH INTEGRINS ALCHEMIA LIMITED (AU) 2011-07-07 US disclosed
EP-1797428-A1 SELECTIVE INHIBITORS Alchemia Pty Ltd (AU) 2007-06-20 EP disclosed
WO-2007038829-A1 METHOD OF DRUG DESIGN ALCHEMIA LTD (AU) 2007-04-12 WO disclosed
WO-2006081616-A1 CLASSES OF COMPOUNDS THAT INTERACT WITH INTEGRINS ALCHEMIA LIMITED (AU) 2006-08-10 WO disclosed
US-20060167237-A1 Derivatives of monosaccharides for drug discovery ALCHEMIA LIMITED (AU) 2006-07-27 US disclosed
WO-2006037159-A1 SELECTIVE INHIBITORS ALCHEMIA LIMITED (AU) 2006-04-13 WO disclosed
EP-1539780-A1 DERIVATIVES OF MONOSACCHARIDES FOR DRUG DISCOVERY Alchemia Limited (AU) 2005-06-15 EP disclosed
US-6765089-B1 FOR USE IN THE SYNTHESIS OF PEPTIDES, OLIGOSACCHARIDES, GLYCOPEPTIDES AND GLYCOLIPIDS ALCHEMIA PTY LTD (AU) 2004-07-20 US disclosed
WO-2004014929-A1 DERIVATIVES OF MONOSACCHARIDES FOR DRUG DISCOVERY ALCHEMIA LIMITED (AU) 2004-02-19 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-20060167237-A1 Derivatives of monosaccharides for drug discovery FBP1, UGGT1, FUT6 L3MBTL1 4723/4885KDM4A 4493/4885KDM4C 3249/4885

“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.