⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1905069 | 1.00 | — | — | |
| SCHEMBL1905071 | 1.00 | — | — | |
| SCHEMBL1298898 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL1298900 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL10983586 | 0.93 | ALDH1A1 (0.69) | — | |
| SCHEMBL10822294 | 0.93 | ALDH1A1 (0.69) | — | |
| SCHEMBL13323112 | 0.93 | ALDH1A1 (0.69) | — | |
| SCHEMBL8996396 | 0.93 | ALDH1A1 (0.69) | — | |
| SCHEMBL10822292 | 0.93 | ALDH1A1 (0.69) | — | |
| SCHEMBL9880636 | 0.93 | ALDH1A1 (0.69) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20190041765-A1 | ELECTROPHOTOGRAPHIC INK INCLUDING A VOLATILE FRAGRANCE | HP INDIGO B.V. (NL) | 2019-02-07 | — | — | US | disclosed |
| WO-2017152964-A1 | ELECTROPHOTOGRAPHIC INK INCLUDING A VOLATILE FRAGRANCE | HP INDIGO B.V. (NL) | 2017-09-14 | — | — | WO | disclosed |
| EP-2295442-A2 | Inhibitors of interleukin-1beta converting enzyme | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-03-16 | — | — | EP | disclosed |
| US-5097375-A | CONTAINER WITH RECORDING MEDIUM AND HAVING A FRAGRANCE EMITTING MATERIAL | BASF AKTIENGESELLSCHAFT (DE) | 1992-03-17 | — | — | US | disclosed |
| US-5097376-A | CONTAINER WITH RECORDING MEDIUM HAVING FRAGRANCE MATERIAL IN OR ON THE RECORDING MEDIUM | BASF AKTIENGESELLSCHAFT (DE) | 1992-03-17 | — | — | US | disclosed |
| EP-0386584-A1 | Container with data carrier | BASF Aktiengesellschaft (DE) | 1990-09-12 | — | — | EP | disclosed |