⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8905793 | 0.96 | ESR1 (0.50) | — | |
| SCHEMBL4449112 | 0.93 | — | — | |
| SCHEMBL8906125 | 0.89 | ESR1 (0.60) | — | |
| SCHEMBL11225131 | 0.87 | — | — | |
| SCHEMBL4526267 | 0.85 | ESR1 (0.48) | — | |
| SCHEMBL1129644 | 0.84 | — | — | |
| SCHEMBL10362326 | 0.84 | — | — | |
| SCHEMBL22017445 | 0.84 | CA12 (0.65) | — | |
| SCHEMBL10362318 | 0.82 | TSHR (0.72) | — | |
| SCHEMBL7919819 | 0.82 | CYP2C19 (0.41) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9023957-B2 | Compound for use in peptide synthesis | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2015-05-05 | — | — | US | claimed |
| US-20130131286-A1 | COMPOUND FOR USE IN PEPTIDE SYNTHESIS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2013-05-23 | — | — | US | claimed |
| EP-2590939-A1 | COMPOUND FOR USE IN PEPTIDE SYNTHESIS | Nanyang Technological University (SG) | 2013-05-15 | — | — | EP | claimed |
| WO-2012005691-A1 | COMPOUND FOR USE IN PEPTIDE SYNTHESIS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2012-01-12 | — | — | WO | claimed |
| US-20050101676-A1 | Amino thiol compounds and compositions for use in conjunction with cancer therapy | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2005-05-12 | — | — | US | claimed |
| WO-2005014524-A2 | AMINO THIOL COMPOUNDS AND COMPOSITIONS FOR USE IN CONJUNCTION WITH CANCER THERAPY | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2005-02-17 | — | — | WO | claimed |
| US-9023957-B2 | Compound for use in peptide synthesis | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2015-05-05 | — | — | US | disclosed |
| US-20130131286-A1 | COMPOUND FOR USE IN PEPTIDE SYNTHESIS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2013-05-23 | — | — | US | disclosed |
| EP-2590939-A1 | COMPOUND FOR USE IN PEPTIDE SYNTHESIS | Nanyang Technological University (SG) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012005691-A1 | COMPOUND FOR USE IN PEPTIDE SYNTHESIS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2012-01-12 | — | — | WO | disclosed |
| US-7314959-B2 | Amino thiol compounds and compositions for use in conjunction with cancer therapy | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2008-01-01 | — | — | US | disclosed |
| US-20050101676-A1 | Amino thiol compounds and compositions for use in conjunction with cancer therapy | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2005-05-12 | — | — | US | disclosed |
| WO-2005014524-A2 | AMINO THIOL COMPOUNDS AND COMPOSITIONS FOR USE IN CONJUNCTION WITH CANCER THERAPY | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2005-02-17 | — | — | WO | disclosed |