SCHEMBL1769263

SCHEMBL1769263

CC(CO)(CO)C(N)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
SLC7A5 Q01650 2/20 0.36
GRIK1 P39086 3/20 0.35
SLC1A1 P43005 5/20 0.33
SLC7A11 Q9UPY5 1/20 0.33
SLC1A2 P43004 5/20 0.32
SLC1A3 P43003 4/20 0.32
USP2 O75604 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32
KIF11 P52732 1/20 0.32
GRIK2 Q13002 1/20 0.31
ENPEP Q07075 1/20 0.31

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
SCHEMBL5288950 0.80 ALDH1A1 (0.52) PTGS1ALDH1A1MAPTSLC7A5GRIK1
SCHEMBL4851556 0.80 PTGS1 (0.52) PTGS1ALDH1A1MAPTSLC7A5GRIK1
SCHEMBL4956090 0.80 PTGS1 (0.52) PTGS1ALDH1A1MAPTSLC7A5GRIK1
SCHEMBL1236211 0.78 ALDH1A1 (0.50) PTGS1ALDH1A1MAPTSLC7A5GRIK1
SCHEMBL1236209 0.78 ALDH1A1 (0.50) PTGS1ALDH1A1MAPTSLC7A5GRIK1
SCHEMBL21296364 0.74 PTGS1 (0.44) PTGS1ALDH1A1MAPTSLC7A5GRIK1
SCHEMBL24015558 0.73 ALDH1A1 (0.45) PTGS1ALDH1A1MAPTSLC7A5GRIK1
SCHEMBL22648921 0.73 MAPT (0.45) PTGS1ALDH1A1MAPTGRIK1SLC1A1
SCHEMBL10443781 0.73 ALDH1A1 (0.45) PTGS1ALDH1A1MAPTGRIK1SLC1A1
Guanidine SCHEMBL27516721 0.73 PTGS1 (0.45) PTGS1ALDH1A1MAPTSLC7A5GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2501412-A1 SALT FORM OF A MULTI-ARM POLYMER-DRUG CONJUGATE Nektar Therapeutics (US) 2012-09-26 EP disclosed
WO-2011063158-A1 SALT FORM OF A MULTI-ARM POLYMER-DRUG CONJUGATE NEKTAR THERAPEUTICS (US) 2011-05-26 WO disclosed