SCHEMBL2452134

SCHEMBL2452134

CN(C)C(=N)[N+](C)(C)C.CO[PH](=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
SCHEMBL2522282 0.78
SCHEMBL2449856 0.75
Potassium Ion SCHEMBL1674510 0.66
SCHEMBL29130614 0.66
SCHEMBL3310167 0.66
Zinc Ion SCHEMBL28390650 0.66
SCHEMBL2174035 0.66
Potassium Ion SCHEMBL7126706 0.66
SCHEMBL7120709 0.66
SCHEMBL8993575 0.66

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
EP-2547822-B1 PROCESS FOR FIBRILLATING LIGNOCELLULOSIC MATERIAL, FIBRES AND THEIR USE UNIV HELSINKI (FI) 2014-07-02 EP disclosed
EP-2547822-A1 PROCESS FOR FIBRILLATING LIGNOCELLULOSIC MATERIAL, FIBRES AND THEIR USE University Of Helsinki (FI) 2013-01-23 EP disclosed
WO-2011114004-A1 PROCESS FOR FIBRILLATING LIGNOCELLULOSIC MATERIAL, FIBRES AND THEIR USE UNIVERSITY OF HELSINKI (FI) 2011-09-22 WO disclosed