⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3686513 | 0.78 | — | — | |
| SCHEMBL11598998 | 0.78 | — | — | |
| SCHEMBL7037706 | 0.74 | — | — | |
| SCHEMBL7039580 | 0.73 | — | — | |
| SCHEMBL8853322 | 0.71 | THRB (0.32) | — | |
| SCHEMBL9723207 | 0.71 | — | — | |
| SCHEMBL537766 | 0.71 | THRB (0.32) | — | |
| SCHEMBL34475 | 0.70 | — | — | |
| SCHEMBL7039582 | 0.67 | — | — | |
| SCHEMBL7044768 | 0.67 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4094943-A | Process for spinning flame retardant elastomeric compositions | NASA | 1978-06-13 | — | — | US | disclosed |
| US-4069212-A | HALOGEN CONTAINING POLYOLS | NASA | 1978-01-17 | — | — | US | disclosed |
| US-3956233-A | Non-flamable elastomeric fiber from a fluorinated elastomer and containing an halogenated flame retardant | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) | 1976-05-11 | — | — | US | disclosed |