⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15539370 | 0.80 | — | — | |
| SCHEMBL28484293 | 0.78 | — | — | |
| SCHEMBL9021953 | 0.75 | — | — | |
| SCHEMBL7760520 | 0.75 | — | — | |
| SCHEMBL167808 | 0.73 | — | — | |
| SCHEMBL7869284 | 0.73 | — | — | |
| SCHEMBL2000957 | 0.73 | — | — | |
| SCHEMBL11279577 | 0.71 | — | — | |
| SCHEMBL8059044 | 0.71 | — | — | |
| SCHEMBL7863843 | 0.71 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020253838-A1 | SILICON-CONTAINING MONOMER CONTAINING DOUBLE OXACYCLIC RINGS, PREPARATION THEREFOR AND USE THEREOF | 湖北固润科技股份有限公司 | 2020-12-24 | — | — | WO | disclosed |
| WO-2020253839-A1 | MIXABLE PHOTOCURABLE POLYSILICON-CONTAINING OXETANE MONOMER AND PREPARATION AND APPLICATION THEREOF | 湖北固润科技股份有限公司 | 2020-12-24 | — | — | WO | disclosed |
| EP-0719839-B1 | Phthalocyanine compounds and optical recording media comprising them | MITSUI CHEMICALS INC (JP) | 2001-07-25 | — | — | EP | disclosed |
| US-5693396-A | NEAR INFRARED LIGHT ABSORBERS | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-12-02 | — | — | US | disclosed |
| EP-0719839-A2 | Phthalocyanine compounds and optical recording media comprising them | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-07-03 | — | — | EP | disclosed |