⚠ 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 | |
|---|---|---|---|---|
| Formaldehyde Sulfinic Acid SCHEMBL246895 | 0.96 | — | — | |
| Formaldehyde Sulfinic Acid SCHEMBL7737743 | 0.96 | CA1 (0.42) | — | |
| Formaldehyde Sulfinic Acid SCHEMBL7963155 | 0.96 | — | — | |
| Formaldehyde Sulfinic Acid SCHEMBL6787 | 0.96 | — | — | |
| Formaldehyde Sulfinic Acid SCHEMBL28319477 | 0.92 | CA1 (0.50) | — | |
| Formaldehyde Sulfinic Acid SCHEMBL946013 | 0.92 | — | — | |
| Formaldehyde Sulfinic Acid SCHEMBL1315569 | 0.92 | — | — | |
| Formaldehyde Sulfinic Acid SCHEMBL20249 | 0.91 | — | — | |
| Formaldehyde Sulfinic Acid SCHEMBL28768068 | 0.91 | — | — | |
| Formaldehyde Sulfinic Acid SCHEMBL10579642 | 0.87 | — | — |
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-4454259-A | FLOCCULATION | BAYER AKTIENGESELLSCHAFT (DE) | 1984-06-12 | — | — | US | disclosed |
| US-4393166-A | Process for the preparation of polyaddition products of isocyanates and denatured biomasses, their use as reactive fillers and as plant nutrients and a process for the production of sheets or shaped articles using the polyaddition products | BAYER AKTIENGESELLSCHAFT (DE) | 1983-07-12 | — | — | US | disclosed |