⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29133501 | 0.83 | ALDH1A1 (0.36) | — | |
| SCHEMBL1890237 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL229600 | 0.74 | ALDH1A1 (0.34) | — | |
| SCHEMBL231682 | 0.72 | ALDH1A1 (0.32) | — | |
| SCHEMBL749895 | 0.68 | ALDH1A1 (0.33) | — | |
| SCHEMBL11208846 | 0.68 | — | — | |
| SCHEMBL5908132 | 0.68 | — | — | |
| SCHEMBL728097 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL10619983 | 0.67 | MAOA (0.36) | — | |
| SCHEMBL2728355 | 0.65 | ALDH1A1 (0.40) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160235650-A1 | Cosmetic Formulation Incorporating a UV-Triggered Self-Healing Material | AVON PRODUCTS, INC. | 2016-08-18 | — | — | US | claimed |
| US-9200089-B2 | Self-repairing cyclic oxide-substituted chitosan polyurethane networks | THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) | 2015-12-01 | — | — | US | claimed |
| WO-2014149469-A1 | COSMETIC FORMULATION INCORPORATING A UV-TRIGGERED SELF-HEALING MATERIAL | AVON PRODUCTS, INC (US) | 2014-09-25 | — | — | WO | claimed |
| US-20140127420-A1 | SELF-REPAIRING CYCLIC OXIDE-SUBSTITUTED CHITOSAN POLYURETHANE NETWORKS | THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) | 2014-05-08 | — | — | US | claimed |
| US-20100266784-A1 | Self-Repairing Cyclic Oxide-Substituted Chitosan Polyurethane Networks | NATIONAL SCIENCE FOUNDATION | 2010-10-21 | — | — | US | claimed |
| US-20160235650-A1 | Cosmetic Formulation Incorporating a UV-Triggered Self-Healing Material | AVON PRODUCTS, INC. | 2016-08-18 | — | — | US | disclosed |
| US-9200089-B2 | Self-repairing cyclic oxide-substituted chitosan polyurethane networks | THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) | 2015-12-01 | — | — | US | disclosed |
| WO-2014149469-A1 | COSMETIC FORMULATION INCORPORATING A UV-TRIGGERED SELF-HEALING MATERIAL | AVON PRODUCTS, INC (US) | 2014-09-25 | — | — | WO | disclosed |
| US-20140127420-A1 | SELF-REPAIRING CYCLIC OXIDE-SUBSTITUTED CHITOSAN POLYURETHANE NETWORKS | THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) | 2014-05-08 | — | — | US | disclosed |
| US-8658786-B2 | Self-repairing cyclic oxide-substituted chitosan polyurethane networks | THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) | 2014-02-25 | — | — | US | disclosed |
| US-20100266784-A1 | Self-Repairing Cyclic Oxide-Substituted Chitosan Polyurethane Networks | NATIONAL SCIENCE FOUNDATION | 2010-10-21 | — | — | US | disclosed |