SCHEMBL9501688

SCHEMBL9501688

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

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33

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
Fumaric Acid SCHEMBL9795168 0.91 MEN1 (0.30)
SCHEMBL9498682 0.90 PAOX (0.37) KDM4EMAPT
Fumaric Acid SCHEMBL9795216 0.82 KDM4E (0.33) KDM4EMAPT
SCHEMBL9499367 0.80 KDM4E (0.32) KDM4EMAPT
SCHEMBL9497937 0.80 HTT (0.40) KDM4EMAPT
SCHEMBL9497850 0.79
SCHEMBL9501641 0.78 LMNA (0.36) KDM4E
SCHEMBL9500160 0.77 BCHE (0.41) KDM4EMAPT
SCHEMBL9497614 0.76 ALDH1A1 (0.44) KDM4E
SCHEMBL16873146 0.73 GAA (0.36)

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-0367019-B1 PHARMACEUTICAL COMPOSITIONS CONTAINING NITROXYALKYL AMINE WITH AN AMIDE FUNCTION, AND METHOD FOR THE PREPARATION OF THE COMPOUNDS Roche Diagnostics GmbH (DE) 1993-05-12 EP disclosed
EP-0367019-A1 Pharmaceutical compositions containing nitroxyalkyl amine with an amide function, and method for the preparation of the compounds Roche Diagnostics GmbH (DE) 1990-05-09 EP disclosed