⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21008478 | 0.86 | — | — | |
| SCHEMBL12432085 | 0.85 | — | — | |
| SCHEMBL22171347 | 0.82 | KMT2A (0.30) | — | |
| SCHEMBL25982273 | 0.82 | — | — | |
| SCHEMBL24040328 | 0.81 | DGAT1 (0.32) | — | |
| SCHEMBL16410970 | 0.80 | MGLL (0.33) | — | |
| SCHEMBL12107375 | 0.80 | RIPK1 (0.36) | — | |
| SCHEMBL25100285 | 0.79 | CYP1A2 (0.30) | — | |
| SCHEMBL21277902 | 0.78 | — | — | |
| SCHEMBL21277917 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3819308-A1 | PROCESS FOR THE MANUFACTURE OF DERIVATIZED AMINO ACIDS | Fresenius Kabi iPSUM S.r.l. (IT) | 2021-05-12 | — | — | EP | disclosed |