⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18492749 | 0.79 | — | — | |
| SCHEMBL3151070 | 0.77 | — | — | |
| SCHEMBL20908043 | 0.75 | — | — | |
| SCHEMBL18340998 | 0.75 | — | — | |
| SCHEMBL14690688 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL20531748 | 0.73 | USP2 (0.34) | — | |
| SCHEMBL3369779 | 0.73 | — | — | |
| SCHEMBL6464707 | 0.71 | — | — | |
| Oxalic Acid SCHEMBL14842438 | 0.71 | USP2 (0.33) | — | |
| SCHEMBL19742579 | 0.71 | — | — |
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-20100311715-A1 | ALPHA CARBOLINES AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2010-12-09 | — | — | US | disclosed |
| EP-1989203-A2 | ALPHA CARBOLINES AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2008-11-12 | — | — | EP | disclosed |
| WO-2007097981-A2 | ALPHA CARBOLINES AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2007-08-30 | — | — | WO | disclosed |