⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1676683 | 1.00 | — | — | |
| SCHEMBL6852866 | 1.00 | — | — | |
| SCHEMBL1676681 | 1.00 | — | — | |
| SCHEMBL6852863 | 1.00 | — | — | |
| SCHEMBL5312610 | 1.00 | — | — | |
| SCHEMBL6244444 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL7610492 | 0.73 | ALDH1A1 (0.34) | — | |
| SCHEMBL1657591 | 0.73 | ALDH1A1 (0.36) | — | |
| SCHEMBL4957734 | 0.73 | ALDH1A1 (0.36) | — | |
| SCHEMBL1657594 | 0.73 | ALDH1A1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0296122-B1 | CYCLOSPORINS AND THEIR USE AS PHARMACEUTICALS | SANDOZ AG (CH) | 1993-09-29 | — | — | EP | claimed |
| EP-0296122-A2 | Cyclosporins and their use as pharmaceuticals | SANDOZ AG (CH) | 1988-12-21 | — | — | EP | claimed |
| US-5525590-A | IMMUNOSUPPRESSANTS, ANTIINFLAMMATORY AND ANTIPARASITIC | SANDOZ LTD. (CH) | 1996-06-11 | — | — | US | disclosed |
| EP-0296122-B1 | CYCLOSPORINS AND THEIR USE AS PHARMACEUTICALS | SANDOZ AG (CH) | 1993-09-29 | — | — | EP | disclosed |
| EP-0296122-A2 | Cyclosporins and their use as pharmaceuticals | SANDOZ AG (CH) | 1988-12-21 | — | — | EP | disclosed |