⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3411567 | 0.88 | HCRTR1 (0.30) | — | |
| SCHEMBL3413835 | 0.82 | — | — | |
| SCHEMBL21802332 | 0.72 | CRHR1 (0.36) | — | |
| SCHEMBL3411568 | 0.70 | — | — | |
| SCHEMBL15189789 | 0.69 | — | — | |
| SCHEMBL19468565 | 0.69 | TAS1R3 (0.31) | — | |
| Hydrochloric Acid SCHEMBL5274126 | 0.68 | TAS1R3 (0.31) | — | |
| SCHEMBL3411285 | 0.66 | MAPT (0.31) | — | |
| SCHEMBL2144645 | 0.65 | CRHR1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL1004607 | 0.65 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2260047-A1 | METHOD FOR MANUFACTURING RUTHENIUM CARBENE COMPLEXES | Evonik Degussa GmbH (DE) | 2010-12-15 | — | — | EP | disclosed |
| WO-2009124977-A1 | METHOD FOR MANUFACTURING RUTHENIUM CARBENE COMPLEXES | EVONIK DEGUSSA GMBH (DE) | 2009-10-15 | — | — | WO | disclosed |