⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27990233 | 0.75 | — | — | |
| SCHEMBL208619 | 0.75 | — | — | |
| SCHEMBL5527104 | 0.75 | — | — | |
| SCHEMBL200206 | 0.72 | — | — | |
| SCHEMBL8852783 | 0.72 | ALDH1A1 (0.38) | — | |
| SCHEMBL17517389 | 0.72 | — | — | |
| SCHEMBL9814035 | 0.72 | TSHR (0.47) | — | |
| SCHEMBL85234 | 0.72 | — | — | |
| SCHEMBL28815222 | 0.71 | — | — | |
| SCHEMBL16335239 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024112065-A1 | METHOD FOR PREPARING LINKER-DRUG CONJUGATE | 주식회사 레고켐 바이오사이언스 | 2024-05-30 | — | — | WO | disclosed |
| US-8791121-B2 | Oligooxopiperazines and methods of making and using them | NEW YORK UNIVERSITY (US) | 2014-07-29 | — | — | US | disclosed |