⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8911976 | 0.71 | — | — | |
| SCHEMBL1255804 | 0.71 | — | — | |
| SCHEMBL11598373 | 0.58 | — | — | |
| SCHEMBL9336204 | 0.58 | — | — | |
| SCHEMBL454187 | 0.58 | — | — | |
| SCHEMBL28729514 | 0.58 | — | — | |
| Nitrogen SCHEMBL11367763 | 0.58 | — | — | |
| SCHEMBL11598376 | 0.58 | — | — | |
| SCHEMBL8433806 | 0.50 | — | — | |
| SCHEMBL9681539 | 0.50 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5084499-A | Calcium phosphite and polyvinyl chloride to prevent plating out | RHONE-POULENC INC. (US) | 1992-01-28 | — | — | US | disclosed |
| US-4760099-A | Polyol, halogenated organic blowing agent, amine catalyst organometallic compound, polyester polyol, surfactant, a-methylstyrene, polymethylene polyphenyleneisocyanate | SLOSS INDUSTRIES CORPORATION (US) | 1988-07-26 | — | — | US | disclosed |