SCHEMBL28013370

SCHEMBL28013370

NCC(=O)OC(=O)OC(=O)CN.O[AlH]O.O[AlH]O.[NaH].[NaH]

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GLRA1 P23415 1/20 0.32
SLC6A9 P48067 1/20 0.32
OR51E2 Q9H255 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
SCHEMBL1666322 0.92 GLRA1 (0.37) GLRA1SLC6A9OR51E2
SCHEMBL25362121 0.92 GLRA1 (0.37) GLRA1SLC6A9OR51E2
SCHEMBL28221695 0.92 GLRA1 (0.37) GLRA1SLC6A9OR51E2
SCHEMBL16602 0.92 GLRA1 (0.37) GLRA1SLC6A9OR51E2
SCHEMBL723808 0.89 GLRA1 (0.39) GLRA1SLC6A9OR51E2
Hydrochloric Acid SCHEMBL22518913 0.86 KDM4E (0.34) GLRA1SLC6A9OR51E2
SCHEMBL6237274 0.86 GLRA1 (0.37) GLRA1SLC6A9OR51E2
SCHEMBL6237184 0.86 GLRA1 (0.37) GLRA1SLC6A9OR51E2
SCHEMBL583140 0.86 GLRA1 (0.37) GLRA1SLC6A9OR51E2
SCHEMBL2586658 0.86 GLRA1 (0.37) GLRA1SLC6A9OR51E2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102099015-B Articles of manufacture releasing an active ingredient BIOMOD CONCEPTS INC 2015-05-06 CN disclosed