⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15005 | 0.97 | — | — | |
| SCHEMBL17047583 | 0.97 | TSHR (0.62) | — | |
| Ammonia Solution, Strong SCHEMBL7047525 | 0.95 | — | — | |
| Water SCHEMBL27545150 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL3129031 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL9994533 | 0.92 | ALDH1A1 (0.56) | — | |
| Dimethylamine SCHEMBL35269 | 0.92 | ALDH1A1 (0.56) | — | |
| Acetone SCHEMBL28395964 | 0.92 | ALDH1A1 (0.56) | — | |
| Diethylamine SCHEMBL723350 | 0.90 | ALDH1A1 (0.54) | — | |
| Trimethylammonium SCHEMBL156970 | 0.90 | ALDH1A1 (0.54) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2215134-A2 | REDUCTION OF THE FORMATION OF BIOFILM BY MEANS OF MULTIFUNCTIONAL COPOLYMERS | Henkel AG & Co. KGaA (DE) | 2010-08-11 | — | — | EP | disclosed |
| WO-2009071451-A2 | REDUCTION OF THE FORMATION OF BIOFILM BY MEANS OF MULTIFUNCTIONAL COPOLYMERS | HENKEL AG & CO. KGAA (DE) | 2009-06-11 | — | — | WO | disclosed |
| EP-0457356-B1 | Process for preparing acrylic polymers in suspension | ATOCHEM ELF ITALIA (IT) | 1995-09-13 | — | — | EP | disclosed |
| US-5344901-A | Emulsion polymerization in presence of sulfoacrylamide salt polymer | ATOCHEM INDUSTRIALE S.R.L. (IT) | 1994-09-06 | — | — | US | disclosed |
| EP-0457356-A2 | Process for preparing acrylic polymers in suspension | ELF ATOCHEM ITALIA S.r.l. (IT) | 1991-11-21 | — | — | EP | disclosed |