⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3933264 | 1.00 | — | — | |
| SCHEMBL7804736 | 0.86 | CA1 (0.48) | — | |
| SCHEMBL11043736 | 0.84 | CA1 (0.57) | — | |
| SCHEMBL5935426 | 0.82 | CA1 (0.55) | — | |
| SCHEMBL4434924 | 0.82 | CA1 (0.55) | — | |
| SCHEMBL4428162 | 0.82 | CA1 (0.55) | — | |
| SCHEMBL8573656 | 0.82 | CA1 (0.55) | — | |
| SCHEMBL28112995 | 0.82 | CA1 (0.55) | — | |
| SCHEMBL2914469 | 0.82 | SMN1; SMN2 (0.41) | — | |
| SCHEMBL22144904 | 0.82 | SMN1; SMN2 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0581429-B1 | Process for synthesizing cyclic depsipeptides | TAKARA SHUZO CO (JP) | 1997-09-03 | — | — | EP | disclosed |
| US-5633345-A | FUNGICIDE | TAKARA SHUZO CO., LTD. (JP) | 1997-05-27 | — | — | US | disclosed |
| US-5633346-A | CYCLIZATION, FUNGICIDES | TAKARA SHUZO CO., LTD. (JP) | 1997-05-27 | — | — | US | disclosed |
| EP-0581429-A2 | Process for synthesizing cyclic depsipeptides | TAKARA SHUZO CO. LTD. (JP) | 1994-02-02 | — | — | EP | disclosed |