⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17345178 | 0.77 | — | — | |
| SCHEMBL712527 | 0.73 | HTT (0.40) | — | |
| SCHEMBL2470712 | 0.69 | — | — | |
| SCHEMBL6421034 | 0.67 | MEN1 (0.33) | — | |
| SCHEMBL18741082 | 0.66 | NOS2 (0.46) | — | |
| SCHEMBL10432315 | 0.65 | MEN1 (0.43) | — | |
| SCHEMBL1933242 | 0.65 | MEN1 (0.43) | — | |
| SCHEMBL10900057 | 0.65 | MEN1 (0.43) | — | |
| SCHEMBL6374261 | 0.65 | — | — | |
| SCHEMBL2731154 | 0.63 | — | — |
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-0183374-B1 | N6-DIHYDROXYPROPYLADENOSINES | WARNER-LAMBERT COMPANY (US) | 1989-07-12 | — | — | EP | disclosed |
| US-4616003-A | TREATING SLEEP DISORDERS; SEDATIVES; HYPNOSIS | WARNER-LAMBERT COMPANY (US) | 1986-10-07 | — | — | US | disclosed |
| EP-0183374-A2 | N6-dihydroxypropyladenosines | WARNER-LAMBERT COMPANY (US) | 1986-06-04 | — | — | EP | disclosed |