⚠ 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 | |
|---|---|---|---|---|
| Methylsulfanylmethane SCHEMBL7985077 | 0.72 | — | — | |
| Dibromomethane SCHEMBL20033 | 0.71 | — | — | |
| Methylsulfanylmethane SCHEMBL27928784 | 0.71 | — | — | |
| Methylsulfanylmethane SCHEMBL1618 | 0.71 | — | — | |
| Methylsulfanylmethane SCHEMBL5440614 | 0.71 | — | — | |
| SCHEMBL513581 | 0.71 | — | — | |
| Methylsulfanylmethane SCHEMBL1330443 | 0.71 | — | — | |
| Methylsulfanylmethane SCHEMBL23629453 | 0.69 | — | — | |
| Methylsulfanylmethane SCHEMBL58269 | 0.67 | — | — | |
| Methylsulfanylmethane SCHEMBL9003352 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117362257-A | Intermediate for preparing SGLT inhibitor, and preparation method and application thereof | 广东东阳光药业股份有限公司 | 2024-01-09 | — | — | CN | disclosed |
| EP-0223587-B1 | PHOTOSENSITIVE MATERIALS CONTAINING IONIC DYE COMPOUNDS AS INITIATORS | THE MEAD CORPORATION (US) | 1991-02-13 | — | — | EP | disclosed |
| CN-1036976-A | Radiation curing printing ink and coating composition that wherein contained initiator is an ionic dye compounds | MEAD CORP (US) | 1989-11-08 | — | — | CN | disclosed |
| CN-86108826-A | Contain the photochromics＜del/ of ionic dye compounds〉as initiating agent | — | 1987-11-25 | — | — | CN | disclosed |