⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7701902 | 0.91 | — | — | |
| SCHEMBL536801 | 0.75 | NOS2 (0.41) | — | |
| SCHEMBL536803 | 0.75 | NOS2 (0.41) | — | |
| SCHEMBL5698965 | 0.74 | — | — | |
| SCHEMBL4204012 | 0.71 | MEN1 (0.30) | — | |
| SCHEMBL1822238 | 0.71 | MEN1 (0.30) | — | |
| SCHEMBL2399001 | 0.71 | — | — | |
| SCHEMBL17688357 | 0.70 | — | — | |
| SCHEMBL1871785 | 0.69 | — | — | |
| SCHEMBL27914325 | 0.69 | POLB (0.31) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4075263-A | Process for preventing hydrolytic degradation of linear saturated aromatic polyesters comprising a thermoplastic saturated aromatic polyester and a moisture scavenger polymer | ROHM AND HAAS COMPANY (US) | 1978-02-21 | — | — | US | disclosed |