⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13908677 | 0.79 | — | — | |
| SCHEMBL1911353 | 0.74 | CTSK (0.36) | — | |
| SCHEMBL12849238 | 0.74 | CTSK (0.36) | — | |
| SCHEMBL18483479 | 0.71 | HCRTR2 (0.30) | — | |
| SCHEMBL10136430 | 0.71 | — | — | |
| SCHEMBL14562847 | 0.70 | — | — | |
| SCHEMBL19398665 | 0.70 | — | — | |
| SCHEMBL18239640 | 0.68 | — | — | |
| SCHEMBL12722103 | 0.68 | — | — | |
| SCHEMBL10421010 | 0.68 | EPHX1 (0.32) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4965342-A | BRANCHED, ATACTIC, HIGHLY CRYSTALLINE | ARIZONA BOARD OF REGENTS, ACTING ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 1990-10-23 | — | — | US | disclosed |
| EP-0345074-A1 | High molecular weight polymers and copolymers of 3-hydroxyoxetane and derivatives thereof. | ARIZONA BOARD OF REGENTS (US) | 1989-12-06 | — | — | EP | disclosed |
| EP-0345073-A1 | Poly (3-(Substituted)-3(Hydroxymethyl) oxetane) and method of preparing same | ARIZONA BOARD OF REGENTS (US) | 1989-12-06 | — | — | EP | disclosed |
| US-4833183-A | FILMS, FIBERS, MOLDING MATERIALS EXPLOSIVES | ARIZONA BOARD OF REGENTS (US) | 1989-05-23 | — | — | US | disclosed |