SCHEMBL1310348

SCHEMBL1310348

CC(O)(CO)[N+](=O)[O-]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL324864 0.80
Methyl Alcohol SCHEMBL28086992 0.78 LMNA (0.46)
SCHEMBL5356080 0.78
Nitric Acid SCHEMBL3751300 0.76 LMNA (0.44)
SCHEMBL1700893 0.74 LMNA (0.48)
SCHEMBL220203 0.74
SCHEMBL17054357 0.74
SCHEMBL27715965 0.72 LMNA (0.41)
SCHEMBL10897965 0.72
SCHEMBL8134614 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104926661-A Synthetic method for bronopol TIANJIN VOCATIONAL INST 2015-09-23 CN claimed
CN-109369410-A A kind of synthetic method of bronopol metabolin 上海海洋大学 2019-02-22 CN disclosed
CN-104926661-A Synthetic method for bronopol TIANJIN VOCATIONAL INST 2015-09-23 CN disclosed
CN-104926661-A Synthetic method for bronopol TIANJIN VOCATIONAL INST 2015-09-23 CN disclosed
EP-2355983-B1 FOUNTAIN SOLUTION REGULATION HESTEREN DRS J J A VAN (NL) 2012-10-10 EP disclosed
US-20110271858-A1 FOUNTAIN SOLUTION REGULATION DRS. J. J. A.VAN HESTEREN (NL) 2011-11-10 US disclosed
EP-2355983-A1 FOUNTAIN SOLUTION REGULATION Hesteren, Drs. J. J. A., Van (NL) 2011-08-17 EP disclosed
WO-2010056114-A1 FOUNTAIN SOLUTION REGULATION HESTEREN, DRS. J., J., A., VAN (NL) 2010-05-20 WO disclosed
CN-101200430-A Improved method for synthesizing bronopol TIANJIN PROFESSIONAL COLLEGE (CN) 2008-06-18 CN disclosed
US-7276109-B2 Fountain solutions containing antipiling macromolecules STOCKEL RICHARD F 2007-10-02 US disclosed
US-20050217534-A1 Fountain solutions containing antipiling macromolecules STOCKEL RICHARD F 2005-10-06 US disclosed