⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL42684 | 0.96 | — | — | |
| Methylamine SCHEMBL28198928 | 0.89 | — | — | |
| SCHEMBL6285125 | 0.86 | CA1 (0.31) | — | |
| Sulfurous Acid SCHEMBL28203988 | 0.83 | — | — | |
| Guanidine SCHEMBL2057451 | 0.75 | CA1 (0.55) | — | |
| Guanidine SCHEMBL735066 | 0.75 | — | — | |
| Guanidine SCHEMBL11341418 | 0.72 | — | — | |
| Guanidine SCHEMBL11335102 | 0.72 | — | — | |
| Guanidine SCHEMBL3140647 | 0.72 | CA1 (0.39) | — | |
| SCHEMBL1261401 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1561764-B1 | Thermoprocessable fluorinated polymers | SOLVAY SOLEXIS SPA (IT) | 2008-06-04 | — | — | EP | disclosed |
| EP-0360993-A2 | Process for increasing the brightness of waste paper by recirculating neutral water | SULZER-ESCHER WYSS GMBH (DE) | 1990-04-04 | — | — | EP | disclosed |