SCHEMBL8974968

SCHEMBL8974968

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

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 1/20 0.32
GRIK1 P39086 2/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
PTGS1 P23219 1/20 0.30
SLC7A5 Q01650 1/20 0.30

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
SCHEMBL17789294 0.80 SLC1A1 (0.34) SLC1A1GRIK1ALDH1A1MAPTPTGS1
SCHEMBL15745571 0.80 SLC1A1 (0.34) SLC1A1GRIK1ALDH1A1MAPTPTGS1
SCHEMBL17085295 0.80 SLC1A1 (0.34) SLC1A1GRIK1ALDH1A1MAPTPTGS1
SCHEMBL76784 0.71
SCHEMBL13430377 0.71
SCHEMBL2603688 0.71
Serine SCHEMBL1127031 0.67
Serine SCHEMBL2166436 0.67 SLC1A1 (0.52) SLC1A1GRIK1PTGS1SLC7A5
Serine SCHEMBL2509471 0.67 SLC1A1 (0.52) SLC1A1GRIK1PTGS1SLC7A5
Serine SCHEMBL28742103 0.67

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
US-5045222-A Liquid detergent formulations HOECHST AKTIENGESELLSCHAFT (DE) 1991-09-03 US claimed
EP-0373546-B1 Use of triacylated ethanolamines as liquid water miscible peroxyde activators HOECHST AG (DE) 1996-04-10 EP disclosed
US-5045222-A Liquid detergent formulations HOECHST AKTIENGESELLSCHAFT (DE) 1991-09-03 US disclosed
EP-0373546-A2 Use of triacylated ethanolamines as liquid water miscible peroxyde activators HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-20 EP disclosed