⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL791435 | 0.76 | — | — | |
| SCHEMBL10005763 | 0.75 | ALDH1A1 (0.35) | — | |
| SCHEMBL8055082 | 0.74 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL9019331 | 0.72 | ALDH1A1 (0.36) | — | |
| SCHEMBL940638 | 0.70 | ALDH1A1 (0.39) | — | |
| SCHEMBL661313 | 0.70 | — | — | |
| SCHEMBL29679050 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL21629497 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL13446089 | 0.69 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL17550621 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6376230-B1 | Stereoselective process for producing intermediates of cryptophycins | ELI LILLY AND COMPANY | 2002-04-23 | — | — | US | disclosed |
| EP-1127055-A2 | STEREOSELECTIVE PROCESS FOR PRODUCING CRYPTOPHYCINS | ELI LILLY AND COMPANY (US) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000023429-A2 | STEREOSELECTIVE PROCESS FOR PRODUCING CRYPTOPHYCINS | ELI LILLY AND COMPANY (US) | 2000-04-27 | — | — | WO | disclosed |