⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7144411 | 0.97 | — | — | |
| SCHEMBL2828421 | 0.71 | — | — | |
| SCHEMBL6575671 | 0.71 | — | — | |
| SCHEMBL2830204 | 0.67 | — | — | |
| SCHEMBL21423699 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL22406169 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL299921 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL22917022 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL22406167 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL575824 | 0.63 | ALDH1A1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0288807-B1 | Conductive structures in polymers | ROTH HANS KLAUS PROF DR (DE) | 1995-01-25 | — | — | EP | disclosed |
| US-4886627-A | Conductive structures in polymers | VEB METALLURGIEELEKTRONIK LEIPZIG (DD) | 1989-12-12 | — | — | US | disclosed |
| EP-0288807-A2 | Conductive structures in polymers | Roth, Hans-Klaus, Prof. Dr. (DE) | 1988-11-02 | — | — | EP | disclosed |