⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2047747 | 0.75 | — | — | |
| SCHEMBL2277233 | 0.71 | — | — | |
| SCHEMBL2154166 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL971234 | 0.69 | — | — | |
| SCHEMBL647392 | 0.67 | ALDH1A1 (0.50) | — | |
| SCHEMBL2154881 | 0.67 | ALDH1A1 (0.50) | — | |
| SCHEMBL59484 | 0.67 | ALDH1A1 (0.50) | — | |
| SCHEMBL21464139 | 0.67 | ALDH1A1 (0.50) | — | |
| SCHEMBL21467312 | 0.67 | ALDH1A1 (0.50) | — | |
| SCHEMBL20068419 | 0.64 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6281365-B1 | ANTITUMOR AGENTS | AMERICAN CYANAMID COMPANY | 2001-08-28 | — | — | US | disclosed |
| EP-0232784-B1 | (GEM-HETEROCYCLODIMETHANAMINE-N,N')PLATINUM COMPLEXES | AMERICAN CYANAMID COMPANY (US) | 1992-12-02 | — | — | EP | disclosed |
| US-4880790-A | ANTICANCER, ANTITUMOR AGENTS | AMERICAN CYANAMID COMPANY (US) | 1989-11-14 | — | — | US | disclosed |
| EP-0232784-A2 | (Gem-heterocyclodimethanamine-N,N')platinum complexes | AMERICAN CYANAMID COMPANY (US) | 1987-08-19 | — | — | EP | disclosed |