⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10049337 | 1.00 | — | — | |
| SCHEMBL9241246 | 0.79 | — | — | |
| SCHEMBL20247880 | 0.76 | — | — | |
| SCHEMBL14211575 | 0.76 | — | — | |
| SCHEMBL8228352 | 0.76 | — | — | |
| SCHEMBL19832798 | 0.74 | — | — | |
| SCHEMBL14047286 | 0.74 | — | — | |
| SCHEMBL9241249 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL17962151 | 0.72 | — | — | |
| SCHEMBL8679761 | 0.72 | — | — |
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-5348977-A | Cobalt complexes as anti-cancer agents | WARNER LAMBERT COMPANY (US) | 1994-09-20 | — | — | US | disclosed |
| US-5276240-A | Zeolite-nickel catalyst | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1994-01-04 | — | — | US | disclosed |
| EP-0496641-A2 | Cobalt complexes as anticancer agents | WARNER-LAMBERT COMPANY (US) | 1992-07-29 | — | — | EP | disclosed |