⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25271557 | 0.79 | — | — | |
| SCHEMBL11981888 | 0.76 | — | — | |
| SCHEMBL28870627 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL18130903 | 0.73 | — | — | |
| SCHEMBL4544183 | 0.73 | — | — | |
| SCHEMBL28450409 | 0.69 | DNM1 (0.47) | — | |
| SCHEMBL11913607 | 0.69 | — | — | |
| SCHEMBL17074305 | 0.69 | — | — | |
| SCHEMBL128487 | 0.67 | PTPN7 (0.46) | — | |
| SCHEMBL6279248 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0980016-B1 | ALIGNING AGENT FOR LIQUID CRYSTAL | NISSAN CHEMICAL IND LTD (JP) | 2008-09-24 | — | — | EP | disclosed |
| US-6274695-B1 | THIN FILM POLYMER | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2001-08-14 | — | — | US | disclosed |
| EP-0980016-A1 | ALIGNING AGENT FOR LIQUID CRYSTAL | Nissan Chemical Industries, Ltd. (JP) | 2000-02-16 | — | — | EP | disclosed |