⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14228437 | 0.76 | — | — | |
| SCHEMBL16849208 | 0.76 | — | — | |
| SCHEMBL989530 | 0.74 | EPHX2 (0.51) | — | |
| SCHEMBL9911058 | 0.71 | — | — | |
| SCHEMBL22922752 | 0.70 | EPHX2 (0.42) | — | |
| SCHEMBL24351983 | 0.69 | NR4A2 (0.38) | — | |
| SCHEMBL19867684 | 0.69 | CTH (0.40) | — | |
| SCHEMBL22899594 | 0.69 | ALDH1A1 (0.41) | — | |
| SCHEMBL18792504 | 0.69 | NR4A2 (0.38) | — | |
| SCHEMBL21769500 | 0.67 | PLA2G2A (0.38) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116802176-A | Oxindoles and methods of use thereof | 阿利戈斯治疗公司 | 2023-09-22 | — | — | CN | disclosed |
| CN-116723844-A | Bicyclic pyridazinones as thyroid hormone receptor beta (TR-beta) agonists | 阿利戈斯治疗公司 | 2023-09-08 | — | — | CN | disclosed |
| CN-116710443-A | 2-pyridones as thyroid hormone receptor modulators | 阿利戈斯治疗公司 | 2023-09-05 | — | — | CN | disclosed |