⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL268640 | 1.00 | — | — | |
| SCHEMBL12502284 | 0.95 | — | — | |
| SCHEMBL8580125 | 0.95 | — | — | |
| SCHEMBL1396032 | 0.95 | — | — | |
| SCHEMBL21174915 | 0.95 | — | — | |
| SCHEMBL15153090 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL12502446 | 0.95 | — | — | |
| SCHEMBL8168449 | 0.91 | — | — | |
| Methylamine SCHEMBL10389657 | 0.88 | — | — | |
| SCHEMBL450001 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106852126-A | Transparent composition and method for delivering skin nursing active component | 阿尔邦国际有限公司 | 2017-06-13 | — | — | CN | disclosed |
| US-5888312-A | USING POLYSILOXANE CLEANING COMPOUNDS | TOSHIBA SILICONE CO., LTD. (JP) | 1999-03-30 | — | — | US | disclosed |
| US-5772781-A | NONAQUEOUS | KABUSHIKI KAISHA TOSHIBA (JP) | 1998-06-30 | — | — | US | disclosed |