⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3772776 | 1.00 | — | — | |
| SCHEMBL3772777 | 1.00 | — | — | |
| SCHEMBL5018045 | 0.80 | TDP1 (0.35) | — | |
| SCHEMBL5018043 | 0.80 | TDP1 (0.35) | — | |
| SCHEMBL3778567 | 0.77 | — | — | |
| SCHEMBL1267516 | 0.77 | TDP1 (0.39) | — | |
| SCHEMBL1267517 | 0.77 | TDP1 (0.39) | — | |
| SCHEMBL5025234 | 0.77 | — | — | |
| SCHEMBL3778571 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL3772779 | 0.75 | TDP1 (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080312466-A1 | Synthesis and intermediates | OHRLEIN REINHOLD | 2008-12-18 | — | — | US | claimed |
| US-20040186313-A1 | Process for the preparation of intermediates useful in the synthesis of statin derivatives especially 7-amino 3 5-dihydroxy heptanoic acid derivatives, and intermediates thereof | CIBA SPECIALTY CHEMICALS CORP. | 2004-09-23 | — | — | US | claimed |