⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4862 | 0.78 | — | — | |
| SCHEMBL9472024 | 0.75 | — | — | |
| SCHEMBL7173321 | 0.73 | — | — | |
| SCHEMBL424765 | 0.73 | — | — | |
| SCHEMBL14483383 | 0.73 | — | — | |
| SCHEMBL28920159 | 0.73 | — | — | |
| Bromoacetal SCHEMBL103234 | 0.71 | — | — | |
| SCHEMBL21618241 | 0.71 | — | — | |
| SCHEMBL5780337 | 0.71 | — | — | |
| SCHEMBL3297413 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1222167-A2 | METHOD FOR PRODUCING INDOLE DERIVATIVES ON A SOLID PHASE | MERCK PATENT GmbH (DE) | 2002-07-17 | — | — | EP | disclosed |
| WO-2001023353-A2 | METHOD FOR PRODUCING INDOLE DERIVATIVES ON A SOLID PHASE | MERCK PATENT GMBH (DE) | 2001-04-05 | — | — | WO | disclosed |