SCHEMBL8201539

SCHEMBL8201539

CC(C)[N+](C)(C)O.O=[N+]([O-])[O-]

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CA5A P35218 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
BBOX1 O75936 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
SCHEMBL8192716 0.88 MEN1 (0.35) MEN1KMT2ACA5ACA5BBBOX1
SCHEMBL8200971 0.84 MEN1 (0.38) MEN1KMT2ACA5ACA5B
SCHEMBL144709 0.79
Fluoride Ion SCHEMBL190899 0.75
SCHEMBL9752218 0.75
Water SCHEMBL190437 0.75
Hydrochloric Acid SCHEMBL2439108 0.75
SCHEMBL8201538 0.75 MEN1 (0.35) MEN1KMT2ACA5ACA5BBBOX1
Bicarbonate SCHEMBL9501836 0.75 BBOX1 (0.39) BBOX1
Acetic Acid SCHEMBL319665 0.75 CA1 (0.50) MEN1KMT2ABBOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6165341-A Catalytic film, methods of making the catalytic films, and electrosynthesis of compounds using the catalytic film SACHEM, INC. (US) 2000-12-26 US disclosed
EP-1021595-A2 ELECTROSYNTHESIS OF HYDROXYLAMMONIUM SALTS AND HYDROXYLAMINE USING A MEDIATOR, A CATALYTIC FILM, METHODS OF MAKING THE CATALYTIC FILM, AND ELECTROSYNTHESIS OF COMPOUNDS USING THE CATALYTIC FILM SACHEM, INC. (US) 2000-07-26 EP disclosed
WO-1999009234-A2 ELECTROSYNTHESIS OF HYDROXYLAMMONIUM SALTS AND HYDROXYLAMINE USING A MEDIATOR, A CATALYTIC FILM, METHODS OF MAKING THE CATALYTIC FILM, AND ELECTROSYNTHESIS OF COMPOUNDS USING THE CATALYTIC FILM SACHEM, INC. (US) 1999-02-25 WO disclosed