⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8875793 | 0.88 | — | — | |
| SCHEMBL18771118 | 0.81 | CA2 (0.37) | — | |
| SCHEMBL824022 | 0.80 | — | — | |
| SCHEMBL8149957 | 0.75 | — | — | |
| SCHEMBL12219351 | 0.75 | — | — | |
| SCHEMBL3432528 | 0.75 | — | — | |
| SCHEMBL29425332 | 0.75 | — | — | |
| SCHEMBL8010552 | 0.75 | — | — | |
| SCHEMBL20201549 | 0.73 | CA2 (0.34) | — | |
| SCHEMBL10866200 | 0.73 | CA2 (0.34) | — |
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-2150515-A1 | ALCOHOL ALKOXYLATES, AGENTS CONTAINING THESE, AND USE OF THE ALCOHOL ALKOXYLATES AS ADJUVANTS FOR THE AGROCHEMICAL FIELD | BASF SE (DE) | 2010-02-10 | — | — | EP | disclosed |
| WO-2008132150-A1 | ALCOHOL ALKOXYLATES, AGENTS CONTAINING THESE, AND USE OF THE ALCOHOL ALKOXYLATES AS ADJUVANTS FOR THE AGROCHEMICAL FIELD | BASF SE (DE) | 2008-11-06 | — | — | WO | disclosed |