SCHEMBL12295331

SCHEMBL12295331

CC(O)C(NS)C(=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
SCHEMBL12295245 1.00
SCHEMBL12295234 1.00
SCHEMBL15002703 1.00
SCHEMBL21242710 1.00
SCHEMBL14819886 1.00
SCHEMBL887967 0.83
SCHEMBL22778050 0.83
SCHEMBL887968 0.83
SCHEMBL29858530 0.80 TP53 (0.47)
SCHEMBL21673293 0.78

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-20220098232-A1 Multicyclic Peptides and Methods for Their Preparation UNIVERSITEIT VAN AMSTERDAM (NL) 2022-03-31 US disclosed
US-11192918-B2 Multicyclic peptides and methods for their preparation STICHTING VOOR DE TECHNISCHE WETENSCHAPPEN (NL) 2021-12-07 US disclosed
US-20200239516-A1 Multicyclic Peptides and Methods for Their Preparation UNIVERSITEIT VAN AMSTERDAM (NL) 2020-07-30 US disclosed
EP-3551642-A1 MULTICYCLIC PEPTIDES AND METHODS FOR THEIR PREPARATION Stichting voor de Technische Wetenschappen (NL) 2019-10-16 EP disclosed
EP-2758426-B1 NOVEL GLUCAGON ANALOGUES NOVO NORDISK AS (DK) 2019-08-07 EP disclosed
WO-2018106112-A1 MULTICYCLIC PEPTIDES AND METHODS FOR THEIR PREPARATION STICHTING VOOR DE TECHNISCHE WETENSCHAPPEN (NL) 2018-06-14 WO disclosed
WO-2011117416-A1 NOVEL GLUCAGON ANALOGUES NOVO NORDISK A/S (DK) 2011-09-29 WO disclosed