SCHEMBL3101630

SCHEMBL3101630

CCCCC(=O)OCCOC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.49
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DNM1 Q05193 1/20 0.39
MAPK1 P28482 3/20 0.39
MAPT P10636 3/20 0.39
RECQL P46063 2/20 0.39
ALDH1A1 P00352 2/20 0.36
PRKCA P17252 6/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PAM P19021 2/20 0.35
HTR2C P28335 1/20 0.35
MGLL Q99685 1/20 0.35

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
SCHEMBL3459097 0.96 DGKA (0.56) DGKAKMT2ASMN1; SMN2DNM1MAPK1
SCHEMBL3109452 0.94 DGKA (0.58) DGKAKMT2ASMN1; SMN2DNM1MAPT
SCHEMBL3459572 0.92 DGKA (0.51) DGKAKMT2ASMN1; SMN2DNM1MAPK1
SCHEMBL3109237 0.91 DGKA (0.40) DGKAKMT2ASMN1; SMN2MAPK1MAPT
SCHEMBL8264298 0.91 DGKA (0.54) DGKAKMT2ASMN1; SMN2DNM1MAPT
SCHEMBL4696895 0.88 DGKA (0.38) DGKAKMT2ASMN1; SMN2MAPK1MAPT
SCHEMBL4698358 0.88 PRKCA (0.39) DGKAMAPK1MAPTRECQLALDH1A1
SCHEMBL20810343 0.88 ADRA2A (0.34) DGKAMAPT
SCHEMBL13541624 0.86 ALDH1A1 (0.42) KMT2ASMN1; SMN2MAPK1RECQLALDH1A1
SCHEMBL4700272 0.85 BRD4 (0.42) DGKAL3MBTL1

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 968/4885KMT2A 1398/4885SMN1; SMN2 2848/4885
US-20080051458-A1 Acyloxyalkyl carbamate prodrugs of alpha-amino acids, methods of synthesis and use ASNS, ASPH, DNPEP DGKA 968/4885KMT2A 1398/4885SMN1; SMN2 2848/4885

“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.