⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7532735 | 0.73 | — | — | |
| SCHEMBL19807316 | 0.71 | — | — | |
| SCHEMBL24334644 | 0.71 | — | — | |
| SCHEMBL24773985 | 0.69 | — | — | |
| SCHEMBL19176336 | 0.69 | — | — | |
| SCHEMBL16205871 | 0.65 | — | — | |
| SCHEMBL17780609 | 0.65 | — | — | |
| SCHEMBL19891044 | 0.63 | — | — | |
| SCHEMBL8281873 | 0.60 | — | — | |
| SCHEMBL24283032 | 0.60 | — | — |
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-3388435-B1 | PYRROLOBENZODIAZEPINES AND TARGETED CONJUGATES | SEAGEN INC (US) | 2023-05-03 | — | — | EP | disclosed |
| US-20210320263-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) | 2021-10-14 | — | — | US | disclosed |