⚠ 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 | |
|---|---|---|---|---|
| Thiourea SCHEMBL26660114 | 0.88 | — | — | |
| Thiourea SCHEMBL30536984 | 0.87 | — | — | |
| Thiourea SCHEMBL30536978 | 0.87 | — | — | |
| Thiourea SCHEMBL1008 | 0.87 | — | — | |
| Thiourea SCHEMBL850383 | 0.87 | — | — | |
| Ethane SCHEMBL29145655 | 0.82 | TSHR (0.50) | — | |
| Thioacetamide SCHEMBL8347261 | 0.82 | — | — | |
| Thiourea SCHEMBL28395455 | 0.82 | — | — | |
| Ethane SCHEMBL5689604 | 0.82 | TSHR (0.50) | — | |
| Ethane SCHEMBL667631 | 0.82 | TSHR (0.50) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110093598-A | For protecting the tin face protective agent of chemical tin coating | 深圳市创智成功科技有限公司 | 2019-08-06 | — | — | CN | claimed |
| CN-104334655-B | Ink composition, ink for inkjet recording, and inkjet recording method | 富士胶片株式会社 | 2016-11-16 | — | — | CN | disclosed |