⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5216765 | 0.73 | — | — | |
| SCHEMBL873801 | 0.73 | — | — | |
| SCHEMBL12005026 | 0.73 | — | — | |
| SCHEMBL2967834 | 0.71 | — | — | |
| SCHEMBL16930144 | 0.70 | — | — | |
| SCHEMBL27340 | 0.70 | — | — | |
| SCHEMBL28291388 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL8686366 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL18189712 | 0.70 | ALDH1A1 (0.31) | — | |
| SCHEMBL7856027 | 0.70 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4491547-A | Fluoromethylthioacetic acid compounds | SHIONOGI & CO., LTD. (JP) | 1985-01-01 | — | — | US | claimed |
| JP-57109761-A | — | — | None | — | — | JP | disclosed |
| JP-3167169-A | — | — | None | — | — | JP | disclosed |
| CN-117124409-A | Preparation method of corrosion-resistant high-antibacterial-property plywood | 江西红锦发木业有限公司 | 2023-11-28 | — | — | CN | disclosed |
| CN-116901193-A | Preparation method of corrosion-resistant high-toughness plywood | 江西红锦发木业有限公司 | 2023-10-20 | — | — | CN | disclosed |
| US-20080177079-A1 | NOVEL PROCESS FOR THE PREPARATION OF (2R)-2-DEOXY-2-FLUORO-2-METHYL-D-ERYTHRO-PENTONO-GAMMA-LACTONE AND (2S)-2-DEOXY-2-FLUORO-2-METHYL-D-ERYTHRO-PENTONO-GAMMA-LACTONE | ROCHE CAROLINA INC. | 2008-07-24 | — | — | US | disclosed |
| JP-H03167169-A | PRODUCTION OF FLUOROMETHYLTHIOACETIC ACIDS | SUMITOMO SEIKA CHEM CO LTD | 1991-07-19 | — | — | JP | disclosed |
| US-4491547-A | Fluoromethylthioacetic acid compounds | SHIONOGI & CO., LTD. (JP) | 1985-01-01 | — | — | US | disclosed |
| US-4491547-A | Fluoromethylthioacetic acid compounds | SHIONOGI & CO., LTD. (JP) | 1985-01-01 | — | — | US | disclosed |
| US-4491547-A | Fluoromethylthioacetic acid compounds | SHIONOGI & CO., LTD. (JP) | 1985-01-01 | — | — | US | disclosed |
| JP-S57109761-A | FLUOROMETHYLTHIOACETIC ACID COMPOUND AND ITS PREPARATION | SHIONOGI & CO LTD | 1982-07-08 | — | — | JP | disclosed |