⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30645405 | 0.89 | — | — | |
| SCHEMBL28808332 | 0.78 | SMN1; SMN2 (0.43) | — | |
| SCHEMBL417617 | 0.77 | — | — | |
| SCHEMBL27951571 | 0.75 | DGAT1 (0.30) | — | |
| SCHEMBL31072115 | 0.75 | TDP1 (0.43) | — | |
| SCHEMBL24040328 | 0.75 | DGAT1 (0.32) | — | |
| SCHEMBL27831971 | 0.73 | DGAT1 (0.38) | — | |
| SCHEMBL12468909 | 0.73 | MGLL (0.31) | — | |
| SCHEMBL29395920 | 0.72 | DGAT1 (0.36) | — | |
| SCHEMBL13447721 | 0.72 | MGLL (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116327974-A | Antibody-drug-conjugates (ADCs) with enzymatically cleavable groups | 拜耳制药股份公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-110312534-B | Antibody-drug-conjugates (ADC) with enzymatically cleavable groups | 拜耳制药股份公司 | 2023-04-04 | — | — | CN | disclosed |