⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23894008 | 0.86 | TSHR (0.37) | — | |
| SCHEMBL20138642 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL24837488 | 0.73 | KDM4E (0.36) | — | |
| SCHEMBL20160167 | 0.72 | TSHR (0.39) | — | |
| SCHEMBL23900911 | 0.69 | CYP2C9 (0.38) | — | |
| SCHEMBL31743251 | 0.68 | MME (0.39) | — | |
| SCHEMBL20529494 | 0.68 | MME (0.39) | — | |
| SCHEMBL20138608 | 0.68 | MME (0.39) | — | |
| SCHEMBL29951883 | 0.67 | MME (0.38) | — | |
| SCHEMBL20159830 | 0.64 | — | — |
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-3888691-A1 | CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LIKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS | Hangzhou Dac Biotech Co., Ltd. (CN) | 2021-10-06 | — | — | EP | disclosed |
| WO-2018086139-A1 | CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LIKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS | HANGZHOU DAC BIOTECH CO., LTD (CN) | 2018-05-17 | — | — | WO | disclosed |