⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9469647 | 1.00 | — | — | |
| SCHEMBL9469653 | 1.00 | — | — | |
| SCHEMBL1052042 | 0.92 | KDM1A (0.31) | — | |
| SCHEMBL1052040 | 0.92 | KDM1A (0.31) | — | |
| SCHEMBL6015270 | 0.92 | KDM1A (0.31) | — | |
| SCHEMBL7637190 | 0.89 | — | — | |
| SCHEMBL7640090 | 0.89 | — | — | |
| SCHEMBL7637193 | 0.89 | — | — | |
| SCHEMBL7638599 | 0.89 | — | — | |
| SCHEMBL1052936 | 0.89 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5210349-A | Catalytic hydrogenation using ruthenium catalyst | PHILLIPS PETROLEUM COMPANY (US) | 1993-05-11 | — | — | US | claimed |
| US-5171907-A | Preparation of hydrogenation catalyst and hydrogenation process therewith | PHILLIPS PETROLEUM COMPANY (US) | 1992-12-15 | — | — | US | claimed |
| US-5128296-A | Using activated ruthenium catalyst complexes | PHILLIPS PETROLEUM COMPANY (US) | 1992-07-07 | — | — | US | claimed |
| US-5210349-A | Catalytic hydrogenation using ruthenium catalyst | PHILLIPS PETROLEUM COMPANY (US) | 1993-05-11 | — | — | US | disclosed |
| US-5171907-A | Preparation of hydrogenation catalyst and hydrogenation process therewith | PHILLIPS PETROLEUM COMPANY (US) | 1992-12-15 | — | — | US | disclosed |
| US-5128296-A | Using activated ruthenium catalyst complexes | PHILLIPS PETROLEUM COMPANY (US) | 1992-07-07 | — | — | US | disclosed |