⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28511152 | 1.00 | — | — | |
| SCHEMBL12604446 | 0.74 | — | — | |
| SCHEMBL14221603 | 0.72 | NR1D1 (0.35) | — | |
| SCHEMBL19614935 | 0.69 | POLB (0.33) | — | |
| SCHEMBL19614926 | 0.69 | POLB (0.33) | — | |
| SCHEMBL28335192 | 0.69 | — | — | |
| SCHEMBL28624406 | 0.69 | — | — | |
| SCHEMBL30816700 | 0.69 | — | — | |
| SCHEMBL1712699 | 0.65 | — | — | |
| SCHEMBL1302925 | 0.65 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117980327-A | Specific coupling of antibodies | 杭州多禧生物科技有限公司 | 2024-05-03 | — | — | CN | disclosed |
| CN-108463253-B | Pyrrolobenzodiazepine conjugates | 麦迪穆有限责任公司 | 2022-03-04 | — | — | CN | disclosed |
| CN-109069663-B | Pyrrolobenzodiazepine conjugates | 麦迪穆有限责任公司 | 2022-03-04 | — | — | CN | disclosed |
| CN-113195487-A | 2, 3-diaminosuccinyl conjugate linkers | 杭州多禧生物科技有限公司 | 2021-07-30 | — | — | CN | disclosed |
| CN-109843335-B | Pyrrolobenzodiazepine conjugates | 麦迪穆有限责任公司 | 2021-07-30 | — | — | CN | disclosed |
| CN-112272669-A | Cross-linked pyrrolobenzodiazepine dimer (PBD) derivatives and conjugates thereof | 杭州多禧生物科技有限公司 | 2021-01-26 | — | — | CN | disclosed |