⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5489369 | 0.72 | — | — | |
| SCHEMBL15933128 | 0.67 | — | — | |
| SCHEMBL1415224 | 0.67 | — | — | |
| SCHEMBL166474 | 0.67 | — | — | |
| SCHEMBL2989001 | 0.65 | — | — | |
| SCHEMBL6655598 | 0.65 | — | — | |
| SCHEMBL9126893 | 0.65 | ALDH1A1 (0.36) | — | |
| SCHEMBL8530081 | 0.62 | — | — | |
| SCHEMBL43934 | 0.61 | — | — | |
| Bicarbonate SCHEMBL5085264 | 0.60 | CA1 (0.42) | — |
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-0178106-B1 | ENZYMATIC PROCESS | NOVO NORDISK A/S (DK) | 1993-03-31 | — | — | EP | claimed |
| EP-0178106-A2 | Enzymatic process | NOVO NORDISK A/S (DK) | 1986-04-16 | — | — | EP | claimed |
| EP-0901468-B1 | PREPARATION OF LACTAMS FROM ALIPHATIC ALPHA,OMEGA-DINITRILES | DU PONT (US) | 2004-07-14 | — | — | EP | disclosed |
| EP-0178106-B1 | ENZYMATIC PROCESS | NOVO NORDISK A/S (DK) | 1993-03-31 | — | — | EP | disclosed |
| EP-0178106-A2 | Enzymatic process | NOVO NORDISK A/S (DK) | 1986-04-16 | — | — | EP | disclosed |