⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11863025 | 0.68 | — | — | |
| SCHEMBL11606260 | 0.63 | — | — | |
| SCHEMBL11141917 | 0.62 | — | — | |
| SCHEMBL7934645 | 0.60 | — | — | |
| Acetone SCHEMBL10630317 | 0.59 | CRBN (0.38) | — | |
| SCHEMBL22462262 | 0.58 | — | — | |
| SCHEMBL9718502 | 0.57 | — | — | |
| Acetic Acid SCHEMBL22528393 | 0.57 | FFAR3 (0.41) | — | |
| Acetic Acid SCHEMBL10972398 | 0.57 | — | — | |
| Acetic Acid SCHEMBL8821821 | 0.57 | FFAR3 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6022522-A | DETECTABLY LABELED BICONJUGATE COMPOUND WHICH COMPRISES A MONOCLONAL ANTIBODY AND A TECHTINIUM-99M COUPLED TO A CHELATING AGENT HAVING A RIGID CYCLIC HYDROCARBON BACKBONE OF GIVEN FORMULA, COUPLED TO THE MONOCLONAL ANTIBODY | BROOKHAVEN SCIENCE ASSOCIATES (US) | 2000-02-08 | — | — | US | disclosed |
| US-5783169-A | RADIOIMMUNOCONJUGATED; DIAGNOSTIC AND THERAPY | BROOKHAVEN SCIENCE ASSOCIATES LLC (US) | 1998-07-21 | — | — | US | disclosed |