SCHEMBL8991581

SCHEMBL8991581

CSCC[C@@H](N)C=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
SCHEMBL308246 1.00
SCHEMBL8146654 1.00
SCHEMBL28636621 0.98
SCHEMBL12962139 0.86
SCHEMBL11999135 0.84
SCHEMBL29183013 0.81
SCHEMBL24575777 0.76
SCHEMBL21896082 0.76
SCHEMBL41166 0.76
SCHEMBL11287329 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9102708-B2 Methods for the synthesis of dicarba bridges in organic compounds SYNGENE LIMITED (AU) 2015-08-11 US disclosed
US-8357638-B2 Oligonucleotide library encoding randomised peptides ASTON UNIVERSITY (GB) 2013-01-22 US disclosed
US-8188217-B2 2012-05-29 US disclosed
US-8124726-B2 Contoxin analogues and methods for synthesizing same MONASH UNIVERSITY (AU) 2012-02-28 US disclosed
US-20100036089-A1 Methods for the Synthesis of Dicarba Bridges in Organic Compounds MONASH UNIVERSITY (AU) 2010-02-11 US disclosed
US-20100022749-A1 Contoxin Analogues and Methods for Synthesizing Same MONASH UNIVERSITY (AU) 2010-01-28 US disclosed
US-20090264313-A1 Oligonucleotide library encoding randomised peptides ASTON UNIVERSITY (GB) 2009-10-22 US disclosed
US-7541143-B2 Homo-doubly labeled compositions for the detection of enzyme activity in biological samples ONCOIMMUNIN, INC. (US) 2009-06-02 US disclosed
US-20070280939-A1 Prostatic Acid Phosphatase Antigens NOTTINGHAM TRENT UNIVERSITY, THE (GB) 2007-12-06 US disclosed
US-20070243562-A1 Lectins for Analyzing Sugar Chains and Method of Using the Same SUMMIT GLYCORESEARCH CORPORATION (JP) 2007-10-18 US disclosed