⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21732714 | 0.96 | TSHR (0.31) | — | |
| SCHEMBL25670422 | 0.94 | — | — | |
| SCHEMBL24025402 | 0.93 | — | — | |
| SCHEMBL21732898 | 0.91 | TSHR (0.34) | — | |
| SCHEMBL21732712 | 0.91 | TSHR (0.34) | — | |
| SCHEMBL25670423 | 0.91 | — | — | |
| SCHEMBL21732697 | 0.89 | TSHR (0.31) | — | |
| SCHEMBL21732699 | 0.88 | ALOX15 (0.31) | — | |
| SCHEMBL21732468 | 0.88 | — | — | |
| SCHEMBL21732718 | 0.84 | TSHR (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11667866-B2 | Phosphorous containing compounds and uses thereof | AFTON CHEMICAL CORPORATION (US) | 2023-06-06 | — | — | US | disclosed |
| US-11667866-B2 | Phosphorous containing compounds and uses thereof | AFTON CHEMICAL CORPORATION (US) | 2023-06-06 | — | — | US | disclosed |
| US-20210355408-A1 | Phosphorous Containing Compounds and Uses Thereof | AFTON CHEMICAL CORP (US) | 2021-11-18 | — | — | US | disclosed |
| US-11066619-B2 | Phosphorous containing compounds and uses thereof | AFTON CHEMICAL CORPORATION (US) | 2021-07-20 | — | — | US | disclosed |
| US-20200056114-A1 | Phosphorous Containing Compounds and Uses Thereof | AFTON CHEMICAL CORP (US) | 2020-02-20 | — | — | US | disclosed |