⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5009371 | 0.60 | — | — | |
| SCHEMBL1469561 | 0.58 | — | — | |
| SCHEMBL2572293 | 0.58 | LMNA (0.30) | — | |
| SCHEMBL2572609 | 0.58 | LMNA (0.30) | — | |
| Hydrochloric Acid SCHEMBL8054499 | 0.57 | — | — | |
| SCHEMBL4947249 | 0.57 | — | — | |
| SCHEMBL1469091 | 0.57 | — | — | |
| SCHEMBL8652409 | 0.57 | — | — | |
| SCHEMBL8852722 | 0.56 | LMNA (0.32) | — | |
| SCHEMBL8187277 | 0.55 | — | — |
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-5356908-A | Agriculture | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-10-18 | — | — | US | disclosed |
| US-5223523-A | Agriculture | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-06-29 | — | — | US | disclosed |