⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11737719 | 0.92 | OPRM1 (0.48) | — | |
| SCHEMBL7863806 | 0.82 | — | — | |
| SCHEMBL598201 | 0.81 | — | — | |
| SCHEMBL11825500 | 0.80 | — | — | |
| SCHEMBL4756025 | 0.79 | DNM1 (0.41) | — | |
| SCHEMBL11546501 | 0.79 | DNM1 (0.41) | — | |
| SCHEMBL7869286 | 0.78 | — | — | |
| SCHEMBL9433265 | 0.77 | — | — | |
| SCHEMBL125384 | 0.75 | — | — | |
| SCHEMBL16991386 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110964254-A | Polypropylene composite material for shading and eye protecting LED bottom shell and preparation method thereof | 上海日之升科技有限公司 | 2020-04-07 | — | — | CN | disclosed |
| US-20110165415-A1 | SUPERHYDROPHOBIC POLY(DIMETHYLSILOXANE) AND METHODS FOR MAKING THE SAME | EMPIRE TECHNOLOGY DEVELOPMENT LLC | 2011-07-07 | — | — | US | 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 |