⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7986916 | 0.80 | — | — | |
| SCHEMBL166529 | 0.80 | ALDH1A1 (0.50) | — | |
| SCHEMBL297369 | 0.80 | — | — | |
| SCHEMBL22144315 | 0.80 | ALDH1A1 (0.50) | — | |
| SCHEMBL1415615 | 0.80 | ALDH1A1 (0.50) | — | |
| SCHEMBL1732572 | 0.78 | — | — | |
| SCHEMBL263999 | 0.78 | — | — | |
| Propane SCHEMBL6048777 | 0.78 | ALDH1A1 (0.48) | — | |
| SCHEMBL1732517 | 0.78 | — | — | |
| SCHEMBL15155674 | 0.77 | ALDH1A1 (0.42) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150328109-A1 | DERMAL COMPOSITIONS CONTAINING UNNATURAL HYGROSCOPIC AMINO ACIDS | MEDPHARM LIMITED (GB) | 2015-11-19 | — | — | US | disclosed |
| US-20150328109-A1 | DERMAL COMPOSITIONS CONTAINING UNNATURAL HYGROSCOPIC AMINO ACIDS | MEDPHARM LIMITED (GB) | 2015-11-19 | — | — | US | disclosed |
| US-20150328109-A1 | DERMAL COMPOSITIONS CONTAINING UNNATURAL HYGROSCOPIC AMINO ACIDS | MEDPHARM LIMITED (GB) | 2015-11-19 | — | — | US | disclosed |
| CN-104968324-A | Dermal compositions containing unnatural hygroscopic amino acids | MEDPHARM LTD | 2015-10-07 | — | — | CN | disclosed |
| EP-2916811-A1 | DERMAL COMPOSITIONS CONTAINING UNNATURAL HYGROSCOPIC AMINO ACIDS | MedPharm Limited (GB) | 2015-09-16 | — | — | EP | disclosed |
| WO-2014072747-A1 | DERMAL COMPOSITIONS CONTAINING UNNATURAL HYGROSCOPIC AMINO ACIDS | MEDPHARM LIMITED (GB) | 2014-05-15 | — | — | WO | disclosed |
| WO-2014072747-A1 | DERMAL COMPOSITIONS CONTAINING UNNATURAL HYGROSCOPIC AMINO ACIDS | MEDPHARM LIMITED (GB) | 2014-05-15 | — | — | WO | disclosed |
| CN-103588712-A | Pyrimidine compound and preparation method and application thereof | NANJING OCEAN PHARMACEUTICAL TECHNOLOGY CO LTD | 2014-02-19 | — | — | CN | disclosed |
| US-5744278-A | TONER COMPRISING COLORANT AND BINDER RESIN HAVING SPECIFIED PARTICLE SIZE AND GLASS TRANSITION TEMPERATURE, CAPSULE STRUCTURE | CANON KABUSHIKI KAISHA (JP) | 1998-04-28 | — | — | US | disclosed |