⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19601471 | 0.85 | — | — | |
| SCHEMBL916110 | 0.81 | — | — | |
| SCHEMBL18583055 | 0.80 | — | — | |
| SCHEMBL24595105 | 0.80 | — | — | |
| SCHEMBL17812977 | 0.80 | — | — | |
| SCHEMBL20194041 | 0.79 | — | — | |
| SCHEMBL23009699 | 0.76 | L3MBTL1 (0.33) | — | |
| SCHEMBL29719468 | 0.76 | L3MBTL1 (0.33) | — | |
| SCHEMBL24377910 | 0.75 | — | — | |
| SCHEMBL17728290 | 0.75 | CNR2 (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021028518-A1 | PROCESS OF PREPARING 2-(PHENYLIMINO)-3-ALKYL-1,3-THIAZOLIDIN-4-ONES | BAYER AKTIENGESELLSCHAFT (DE) | 2021-02-18 | — | — | WO | disclosed |