⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7328310 | 0.69 | — | — | |
| SCHEMBL6673910 | 0.69 | — | — | |
| SCHEMBL3725333 | 0.69 | — | — | |
| SCHEMBL726341 | 0.63 | — | — | |
| SCHEMBL8961768 | 0.63 | HSP90AA1 (0.33) | — | |
| SCHEMBL687678 | 0.62 | — | — | |
| SCHEMBL373166 | 0.60 | HSP90AA1 (0.50) | — | |
| SCHEMBL5029231 | 0.60 | HSP90AA1 (0.42) | — | |
| SCHEMBL2839784 | 0.60 | CA12 (0.32) | — | |
| Hydrochloric Acid SCHEMBL4760945 | 0.58 | HSP90AA1 (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2002047345-A | POLYMER HAVING SUBSTITUTED TRIAZINE DITHIO STRUCTURE UNIT, ITS MANUFACTURING METHOD AND ELECTROLYTE | NIPPON ZEON CO LTD | 2002-02-12 | — | — | JP | disclosed |
| JP-2002047345-A | POLYMER HAVING SUBSTITUTED TRIAZINE DITHIO STRUCTURE UNIT, ITS MANUFACTURING METHOD AND ELECTROLYTE | NIPPON ZEON CO LTD | 2002-02-12 | — | — | JP | disclosed |
| JP-2000299131-A | POLYELECTROLYTE SECONDARY BATTERY | TORAI ONITSUKUSU KK | 2000-10-24 | — | — | JP | disclosed |