⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8179373 | 0.87 | LMNA (0.31) | — | |
| SCHEMBL13203582 | 0.83 | — | — | |
| SCHEMBL7762922 | 0.81 | TDP1 (0.33) | — | |
| SCHEMBL18602930 | 0.80 | LMNA (0.37) | — | |
| SCHEMBL6258877 | 0.79 | — | — | |
| SCHEMBL4153225 | 0.78 | — | — | |
| SCHEMBL13900625 | 0.76 | CA12 (0.43) | — | |
| SCHEMBL18523206 | 0.75 | CA12 (0.45) | — | |
| SCHEMBL30918585 | 0.73 | ALDH1A1 (0.30) | — | |
| SCHEMBL20803780 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0530515-B1 | Process for the preparation of N-halomethylpyrrole and intermediates | BASF AG (DE) | 2002-11-06 | — | — | EP | disclosed |
| EP-0530515-A1 | N-Alkanoylaminomethyl and N-Aroylaminomethyl pyrrole insecticidal and acaricidal agents | AMERICAN CYANAMID COMPANY (US) | 1993-03-10 | — | — | EP | disclosed |
| US-5130328-A | Lima bean leaves | AMERICAN CYANAMID COMPANY (US) | 1992-07-14 | — | — | US | disclosed |