⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3140955 | 1.00 | — | — | |
| SCHEMBL7112219 | 0.78 | — | — | |
| SCHEMBL3648263 | 0.78 | — | — | |
| SCHEMBL28573550 | 0.78 | — | — | |
| SCHEMBL28363463 | 0.78 | — | — | |
| SCHEMBL1789270 | 0.78 | — | — | |
| SCHEMBL5868374 | 0.76 | — | — | |
| SCHEMBL6577792 | 0.76 | — | — | |
| SCHEMBL19758216 | 0.76 | TSHR (0.38) | — | |
| SCHEMBL5868375 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-11001450-A | — | — | None | — | — | JP | disclosed |
| JP-H111450-A | FLUORINE-CONTAINING ORGANIC COMPOUND | ASAHI GLASS CO LTD | 1999-01-06 | — | — | JP | disclosed |
| US-5834612-A | ALLYL ETHER COMPOUND USEFUL IN HYDROSILYLATION REACTIONS TO PREPARE FLUORINATED POLYSILOXANES, SYNTHETIC OILS, WATER AND OIL REPELLANTS | ASAHI GLASS COMPANY LTD. (JP) | 1998-11-10 | — | — | US | disclosed |