SCHEMBL3109237

SCHEMBL3109237

CCCC(=O)OCCOC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.40
ALDH1A1 P00352 4/20 0.36
NLRP3 Q96P20 1/20 0.34
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PRKCA P17252 3/20 0.33
MAPK1 P28482 3/20 0.33
MAPT P10636 3/20 0.33
GAA P10253 2/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RECQL P46063 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL4696895 0.94 DGKA (0.38) DGKAALDH1A1PRKCAMAPK1MAPT
SCHEMBL4698358 0.94 PRKCA (0.39) DGKAALDH1A1PRKCAMAPK1MAPT
SCHEMBL3101630 0.91 DGKA (0.49) DGKAALDH1A1PRKCAMAPK1MAPT
SCHEMBL20810343 0.90 ADRA2A (0.34) DGKATDP1MAPT
SCHEMBL3459097 0.90 DGKA (0.56) DGKAALDH1A1PRKCAMAPK1MAPT
SCHEMBL3109452 0.88 DGKA (0.58) DGKAALDH1A1KDM4EPRKCAMAPT
SCHEMBL24859350 0.86 TSHR (0.39) DGKAALDH1A1KDM4ETDP1MAPT
SCHEMBL3459572 0.86 DGKA (0.51) DGKAPRKCAMAPK1MAPTKMT2A
SCHEMBL10052377 0.85 ALDH1A1 (0.37) ALDH1A1KDM4ETDP1MAPK1MAPT
SCHEMBL8264298 0.85 DGKA (0.54) DGKAALDH1A1NLRP3PRKCAMAPT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799829-B2 Acyloxyalkyl carbamate prodrugs of α-amino acids, methods of synthesis and use XENOPORT, INC. (US) 2010-09-21 US disclosed
US-20090192225-A1 Acyloxyalkyl Carbamate Prodrugs of Alpha-Amino Acids, Methods of Synthesis and Use XENOPORT, INC. (US) 2009-07-30 US disclosed
US-7531572-B2 Acyloxyalkyl carbamate prodrugs of α-amino acids, methods of synthesis and use XENOPORT, INC. (US) 2009-05-12 US disclosed
EP-1919859-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE Xenoport, Inc. (US) 2008-05-14 EP disclosed
US-20080051458-A1 Acyloxyalkyl carbamate prodrugs of alpha-amino acids, methods of synthesis and use XENOPORT, INC. 2008-02-28 US disclosed
WO-2008013860-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF ALPHA-AMINO ACIDS, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2008-01-31 WO disclosed
WO-2007002013-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2007-01-04 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 (2 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-20090192225-A1 Acyloxyalkyl Carbamate Prodrugs of Alpha-Amino Acids, Methods of Synthesis and Use ASNS, ASPH, DNPEP DGKA 968/4885ALDH1A1 1320/4885NLRP3 4138/4885
US-20080051458-A1 Acyloxyalkyl carbamate prodrugs of alpha-amino acids, methods of synthesis and use ASNS, ASPH, DNPEP DGKA 968/4885ALDH1A1 1320/4885NLRP3 4138/4885

“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.