SCHEMBL526332

SCHEMBL526332

O=C(O)CNCC=CO

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
SCHEMBL14896584 0.81 S1PR1 (0.38)
SCHEMBL232854 0.78
SCHEMBL8520637 0.78 TSHR (0.42)
SCHEMBL866509 0.78
SCHEMBL29956913 0.78
SCHEMBL467341 0.78
SCHEMBL455193 0.78
SCHEMBL4786114 0.78
SCHEMBL17667385 0.76 TSHR (0.36)
Hydrochloric Acid SCHEMBL712887 0.76 PPARG (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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120027677-A1 Prion-specific peptoid reagents NOVARTIS AG 2012-02-02 US claimed
EP-2383281-A2 Prion-specific peptoid reagents Novartis AG (CH) 2011-11-02 EP claimed
EP-0158556-B1 PROCESS FOR THE PREPARATION OF HYDROXYALKYLAMINOACETIC ACIDS SOCIETE FRANCAISE HOECHST Société anonyme dite: (FR) 1987-07-01 EP claimed
US-4602106-A Process for producing hydroxyalkylaminoacetic acids SOCIETE FRANCAISE HOECHST (FR) 1986-07-22 US claimed
EP-1931695-B1 Prion-specific peptoid reagents NOVARTIS AG (CH) 2013-04-10 EP disclosed
US-20120027677-A1 Prion-specific peptoid reagents NOVARTIS AG 2012-02-02 US disclosed
EP-2383281-A2 Prion-specific peptoid reagents Novartis AG (CH) 2011-11-02 EP disclosed
US-20110189692-A1 ASSAY FOR PATHOGENIC CONFORMERS NOVARTIS AG 2011-08-04 US disclosed
EP-2282753-A1 ASSAY FOR PATHOGENIC CONFORMERS Novartis AG (CH) 2011-02-16 EP disclosed
US-7834144-B2 Prion-specific peptoid reagents NOVARTIS AG (CH) 2010-11-16 US disclosed
WO-2009134942-A1 ASSAY FOR PATHOGENIC CONFORMERS NOVARTIS AG. (CH) 2009-11-05 WO disclosed
EP-1931695-A1 PRION-SPECIFIC PEPTOID REAGENTS Novartis AG (CH) 2008-06-18 EP disclosed
US-20070087972-A1 Prion-specific peptoid reagents NOVARTIS AG (CH) 2007-04-19 US disclosed
WO-2007030804-A1 PRION-SPECIFIC PEPTOID REAGENTS NOVARTIS AG (CH) 2007-03-15 WO disclosed
EP-0370145-A1 Process for selectively removing hydrogen sulfide from a gas stream at high pressure MOBIL OIL CORPORATION (US) 1990-05-30 EP disclosed
EP-0248294-A2 Detergent composition Kao Corporation (JP) 1987-12-09 EP disclosed