⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL37556 | 0.98 | — | — | |
| SCHEMBL19770358 | 0.98 | — | — | |
| SCHEMBL37558 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL28664755 | 0.97 | — | — | |
| Hydrazine SCHEMBL28136727 | 0.95 | — | — | |
| SCHEMBL16143655 | 0.94 | — | — | |
| SCHEMBL16143656 | 0.94 | — | — | |
| SCHEMBL28249185 | 0.92 | — | — | |
| SCHEMBL28163447 | 0.89 | — | — | |
| SCHEMBL16266712 | 0.88 | — | — |
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-108368268-A | Titanium complexes as sulfidation catalysts | 汉高股份有限及两合公司 | 2018-08-03 | — | — | CN | disclosed |
| CN-104105766-B | Waterproof coating material and building roof having coating film formed therefrom | 株式会社钟化 | 2016-12-28 | — | — | CN | disclosed |
| CN-103347929-B | Curable compositions | 株式会社钟化 | 2016-10-26 | — | — | CN | disclosed |