⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11052012 | 0.93 | — | — | |
| SCHEMBL26607529 | 0.90 | EPHX2 (0.31) | — | |
| SCHEMBL11047191 | 0.85 | — | — | |
| SCHEMBL2469601 | 0.71 | — | — | |
| SCHEMBL3922740 | 0.71 | — | — | |
| SCHEMBL20380559 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL2994228 | 0.69 | — | — | |
| SCHEMBL19523083 | 0.65 | HTR2A (0.33) | — | |
| SCHEMBL9614345 | 0.64 | — | — | |
| SCHEMBL22673302 | 0.61 | EPHX2 (0.31) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4466924-A | Platinum-diamine complexes, a process for the preparation thereof, a process for the preparation of a medicine using such a platinum-diamine complex for the treatment of malignant tumors in mice as well as a medicine thus formed | NEDERLANDSE CENTRALE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK (NL) | 1984-08-21 | — | — | US | disclosed |