⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17617007 | 0.87 | HSD17B1 (0.31) | — | |
| SCHEMBL17617006 | 0.86 | — | — | |
| SCHEMBL10002014 | 0.85 | PRKDC (0.34) | — | |
| SCHEMBL20147035 | 0.85 | — | — | |
| SCHEMBL14838528 | 0.84 | PPARD (0.31) | — | |
| SCHEMBL17617014 | 0.82 | HSD17B1 (0.32) | — | |
| SCHEMBL17617021 | 0.81 | PRKDC (0.32) | — | |
| SCHEMBL17617017 | 0.81 | PRKDC (0.32) | — | |
| SCHEMBL17617023 | 0.81 | HSD11B1 (0.32) | — | |
| SCHEMBL20146985 | 0.79 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11124524-B2 | Diarylethene compounds and uses thereof | SOLUTIA CANADA INC. (US) | 2021-09-21 | — | — | US | disclosed |
| US-20190256526-A1 | DIARYLETHENE COMPOUNDS AND USES THEREOF | SWITCH MATERIALS, INC. (CA) | 2019-08-22 | — | — | US | disclosed |
| US-20160083398-A1 | DIARYLETHENE COMPOUNDS AND USES THEREOF | SWITCH MATERIALS, INC. (CA) | 2016-03-24 | — | — | US | disclosed |
| US-20160083398-A1 | DIARYLETHENE COMPOUNDS AND USES THEREOF | SWITCH MATERIALS, INC. (CA) | 2016-03-24 | — | — | US | disclosed |