⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28057989 | 0.68 | — | — | |
| Water SCHEMBL28116068 | 0.62 | — | — | |
| Fluoride SCHEMBL28124281 | 0.62 | — | — | |
| SCHEMBL28087037 | 0.57 | — | — | |
| SCHEMBL27909492 | 0.51 | — | — | |
| Fluoride SCHEMBL27943247 | 0.51 | — | — | |
| SCHEMBL42968 | 0.51 | GRIN2D (0.33) | — | |
| SCHEMBL22689491 | 0.51 | — | — | |
| SCHEMBL27886841 | 0.51 | — | — | |
| Hydrochloric Acid SCHEMBL4178849 | 0.46 | GRIN2D (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2893546-B1 | DEVICE AND METHOD FOR MONITORING ROOMS EQUIPPED WITH HIGH-VOLTAGE APPARATUSES | ABB SCHWEIZ AG (CH) | 2017-07-12 | — | — | EP | claimed |
| CN-103631092-A | Formation method for semiconductor structure | SEMICONDUCTOR MFG INT SHANGHAI | 2014-03-12 | — | — | CN | claimed |
| CN-103631092-A | Formation method for semiconductor structure | SEMICONDUCTOR MFG INT SHANGHAI | 2014-03-12 | — | — | CN | disclosed |