⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2107956 | 0.84 | ALDH1A1 (0.32) | — | |
| SCHEMBL27518434 | 0.71 | — | — | |
| SCHEMBL6289261 | 0.70 | PRSS1 (0.31) | — | |
| SCHEMBL334656 | 0.67 | — | — | |
| SCHEMBL175524 | 0.67 | — | — | |
| SCHEMBL335471 | 0.67 | — | — | |
| SCHEMBL2872830 | 0.65 | ALDH1A1 (0.46) | — | |
| SCHEMBL28334728 | 0.65 | — | — | |
| Fluoride SCHEMBL28170948 | 0.65 | — | — | |
| Water SCHEMBL359935 | 0.65 | — | — |
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-0345073-A1 | Poly (3-(Substituted)-3(Hydroxymethyl) oxetane) and method of preparing same | ARIZONA BOARD OF REGENTS (US) | 1989-12-06 | — | — | EP | 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 |
| US-4833183-A | FILMS, FIBERS, MOLDING MATERIALS EXPLOSIVES | ARIZONA BOARD OF REGENTS (US) | 1989-05-23 | — | — | US | disclosed |