⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7635864 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL7627850 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL7637057 | 0.70 | RET (0.31) | — | |
| SCHEMBL7633564 | 0.69 | — | — | |
| SCHEMBL7795217 | 0.67 | RET (0.30) | — | |
| SCHEMBL7198207 | 0.67 | — | — | |
| SCHEMBL6907797 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL8212304 | 0.65 | — | — | |
| SCHEMBL7795224 | 0.65 | RET (0.32) | — | |
| SCHEMBL8210276 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6355819-B1 | TRANSITION METAL METALLOCENES WITH HETEROATOM 1- OR 3-SUBSTITUTED INDENYL AND INDENYL DERIVATIVE LIGANDS | BOREALIS TECHNOLOGY OY (FI) | 2002-03-12 | — | — | US | disclosed |