SCHEMBL2744705

SCHEMBL2744705

N#C[C@@H](N)CCC(=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
SCHEMBL1988711 1.00
SCHEMBL9069778 0.81
SCHEMBL2744870 0.81
SCHEMBL29030244 0.80 CYP2D6 (0.50)
SCHEMBL52133 0.78
SCHEMBL756717 0.78
SCHEMBL690785 0.76
SCHEMBL10806356 0.76
SCHEMBL10402740 0.76
SCHEMBL10821242 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2183273-B1 CYCLIC DEPSIPEPTIDES NOVARTIS AG (CH) 2017-04-05 EP claimed
US-9127044-B2 Cyclic depsipeptides NOVARTIS AG (CH) 2015-09-08 US claimed
US-20120196790-A1 CYCLIC DEPSIPEPTIDES NOVARTIS AG (CH) 2012-08-02 US claimed
US-8178650-B2 Cyclic depsipeptides NOVARTIS AG (CH) 2012-05-15 US claimed
EP-2183273-A1 CYCLIC DEPSIPEPTIDES Novartis Ag (CH) 2010-05-12 EP claimed
US-20090156472-A1 Cyclic Depsipeptides NOVARTIS AG (CH) 2009-06-18 US claimed
WO-2009024527-A1 CYCLIC DEPSIPEPTIDES NOVARTIS AG (CH) 2009-02-26 WO claimed
EP-2183273-B1 CYCLIC DEPSIPEPTIDES NOVARTIS AG (CH) 2017-04-05 EP disclosed
US-9127044-B2 Cyclic depsipeptides NOVARTIS AG (CH) 2015-09-08 US disclosed
US-20120196790-A1 CYCLIC DEPSIPEPTIDES NOVARTIS AG (CH) 2012-08-02 US disclosed
US-8178650-B2 Cyclic depsipeptides NOVARTIS AG (CH) 2012-05-15 US disclosed
EP-2183273-A1 CYCLIC DEPSIPEPTIDES Novartis Ag (CH) 2010-05-12 EP disclosed
US-20090156472-A1 Cyclic Depsipeptides NOVARTIS AG (CH) 2009-06-18 US disclosed
WO-2009024527-A1 CYCLIC DEPSIPEPTIDES NOVARTIS AG (CH) 2009-02-26 WO disclosed