⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4912746 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL22833790 | 0.67 | CPA1 (0.40) | — | |
| SCHEMBL4908884 | 0.64 | CPB2 (0.41) | — | |
| SCHEMBL2979437 | 0.63 | CPA1 (0.35) | — | |
| SCHEMBL4996391 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL23699999 | 0.62 | — | — | |
| SCHEMBL4912605 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL23389223 | 0.60 | CPB2 (0.46) | — | |
| SCHEMBL1796174 | 0.60 | PSEN1 (0.32) | — | |
| SCHEMBL4912398 | 0.59 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8372848-B2 | N-benzylamino cyclic thioureas; obesity and related disorders; (N-(3-{(4S)-1-[(1S)-2-(benzylamino)-1-methylethyl]-3-[2-(3-fluorophenyl)ethyl]-2-thioxoimidazolidin-4-yl}propyl)guanidine | MIXTURE SCIENCES, INC. (US) | 2013-02-12 | — | — | US | disclosed |
| EP-1727540-A4 | MELANIN-CONCENTRATING HORMONE RECEPTOR ANTAGONISTS AND METHODS OF USE | UNIV CALIFORNIA (US) | 2009-07-22 | — | — | EP | disclosed |
| US-20080255218-A1 | Melanin-Concentrating Hormone Receptor Antagonists and Methods of Use | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2008-10-16 | — | — | US | disclosed |
| EP-1727540-A1 | MELANIN-CONCENTRATING HORMONE RECEPTOR ANTAGONISTS AND METHODS OF USE | The Regents Of the University of California (US) | 2006-12-06 | — | — | EP | disclosed |
| WO-2005094817-A1 | MELANIN-CONCENTRATING HORMONE RECEPTOR ANTAGONISTS AND METHODS OF USE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2005-10-13 | — | — | WO | disclosed |