⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13049830 | 0.83 | — | — | |
| SCHEMBL4957529 | 0.81 | — | — | |
| SCHEMBL21341350 | 0.81 | TSHR (0.36) | — | |
| SCHEMBL3774341 | 0.79 | TSHR (0.65) | — | |
| Isonipecotic Acid SCHEMBL104297 | 0.77 | — | — | |
| Bromide SCHEMBL27312283 | 0.77 | TSHR (0.62) | — | |
| Hydrochloric Acid SCHEMBL27430608 | 0.77 | TSHR (0.62) | — | |
| SCHEMBL1484884 | 0.77 | TSHR (0.62) | — | |
| Isonipecotic Acid SCHEMBL2027408 | 0.77 | TSHR (1.00) | — | |
| Hydrochloric Acid SCHEMBL27508984 | 0.77 | TSHR (0.62) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114877898-B | Sun dynamic tracking method based on underwater polarization attitude and refraction coupling inversion | 北京航空航天大学 | 2022-10-18 | — | — | CN | claimed |
| CN-114877898-A | Sun dynamic tracking method based on underwater polarization attitude and refraction coupling inversion | 北京航空航天大学 | 2022-08-09 | — | — | CN | claimed |
| CN-114877898-B | Sun dynamic tracking method based on underwater polarization attitude and refraction coupling inversion | 北京航空航天大学 | 2022-10-18 | — | — | CN | disclosed |
| CN-114877898-A | Sun dynamic tracking method based on underwater polarization attitude and refraction coupling inversion | 北京航空航天大学 | 2022-08-09 | — | — | CN | disclosed |
| WO-2020081918-A2 | ΒETA-CATENIN AND B-CELL LYMPHOMA 9 (BCL9) INHIBITORS | H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) | 2020-04-23 | — | — | WO | disclosed |