⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5177581 | 0.89 | — | — | |
| SCHEMBL8608565 | 0.85 | ALDH1A1 (0.31) | — | |
| SCHEMBL21081707 | 0.81 | ALDH1A1 (0.31) | — | |
| SCHEMBL9235092 | 0.78 | — | — | |
| SCHEMBL1764495 | 0.78 | — | — | |
| SCHEMBL10520682 | 0.77 | — | — | |
| SCHEMBL6736874 | 0.77 | — | — | |
| SCHEMBL17079089 | 0.77 | TNNC1 (0.31) | — | |
| SCHEMBL9894107 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL15879717 | 0.75 | — | — |
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-20070020557-A1 | New organic bottom antireflective polymer compositions | AZ ELECTRONIC MATERIALS USA CORP. | 2007-01-25 | — | — | US | claimed |
| EP-0761734-A1 | Rubber composition | Semperit Reifen Aktiengesellschaft (AT) | 1997-03-12 | — | — | EP | disclosed |