⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7990319 | 0.83 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL7974849 | 0.81 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL7989368 | 0.81 | ALDH1A1 (0.37) | — | |
| SCHEMBL7975476 | 0.79 | RAB9A (0.40) | — | |
| SCHEMBL7986794 | 0.77 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL7975327 | 0.77 | LMNA (0.44) | — | |
| SCHEMBL7987416 | 0.76 | — | — | |
| SCHEMBL7975913 | 0.72 | CCNE1 (0.37) | — | |
| SCHEMBL7988757 | 0.70 | TDP1 (0.33) | — | |
| SCHEMBL7993433 | 0.66 | HTT (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6265418-B1 | ANTICOAGULANTS | UBE INDUSTRIES, LTD. (JP) | 2001-07-24 | — | — | US | disclosed |
| WO-2001009124-A1 | 8-CARBONYL CHROMAN DERIVATIVES, PREPARATION AND THERAPIC USE THEREOF | AVENTIS PHARMA S.A. (FR) | 2001-02-08 | — | — | WO | disclosed |
| EP-1020467-A1 | N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF | UBE INDUSTRIES LIMITED (JP) | 2000-07-19 | — | — | EP | disclosed |