SCHEMBL1963889

SCHEMBL1963889

[CH2]CC(C)(C)C(N)=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
SCHEMBL1327762 0.73
SCHEMBL188468 0.73
SCHEMBL844376 0.73
SCHEMBL15340969 0.73 ACLY (0.39)
SCHEMBL126731 0.73
SCHEMBL127725 0.73
SCHEMBL276535 0.73
SCHEMBL5270837 0.71
Hydrochloric Acid SCHEMBL11595789 0.71
SCHEMBL1026014 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110144197-A1 ALCANOIC ACID AMIDES SUBSTITUTED BY SATURATED O-HETEROCYCLES SPEEDEL EXPERIMENTA AG (CH) 2011-06-16 US disclosed
EP-1937248-A2 ALCANOIC ACID AMIDES SUBSTITUTED BY SATURATED O-HETEROCYCLES Speedel Experimenta AG (CH) 2008-07-02 EP disclosed
EP-1856032-A1 HETEROCYCLIC-SUBSTITUTED ALKANAMIDES USEFUL AS RENIN INHIBITORS Speedel Experimenta AG (CH) 2007-11-21 EP disclosed
WO-2007031557-A2 ALCANOIC ACID AMIDES SUBSTITUTED BY SATURATED O-HETEROCYCLES SPEEDEL EXPERIMENTA AG (CH) 2007-03-22 WO disclosed
EP-1725530-A1 ORGANIC COMPOUNDS Speedel Experimenta AG (CH) 2006-11-29 EP disclosed
WO-2006095020-A1 HETEROCYCLIC-SUBSTITUTED ALKANAMIDES USEFUL AS RENIN INHIBITORS SPEEDEL EXPERIMENTA AG (CH) 2006-09-14 WO disclosed
WO-2005090304-A1 ORGANIC COMPOUNDS SPEEDEL EXPERIMENTA AG (CH) 2005-09-29 WO disclosed