⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11597128 | 0.82 | NPC1 (0.39) | — | |
| SCHEMBL2720667 | 0.81 | ALDH1A1 (0.38) | — | |
| SCHEMBL18542658 | 0.78 | — | — | |
| SCHEMBL11596281 | 0.78 | ALDH1A1 (0.39) | — | |
| SCHEMBL8643550 | 0.77 | SOAT1 (0.36) | — | |
| SCHEMBL2067789 | 0.76 | PIK3CD (0.35) | — | |
| SCHEMBL11597634 | 0.76 | MEN1 (0.32) | — | |
| SCHEMBL21680833 | 0.74 | — | — | |
| SCHEMBL2482457 | 0.74 | — | — | |
| SCHEMBL2718472 | 0.74 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1094742-A | Lattice with solventless coatings of improved wet scrub resistance | CRAY VALLEY SA (FR) | 1994-11-09 | — | — | CN | disclosed |
| EP-0029409-B1 | PROCESS FOR PREPARING 5-CYANO-5H-DIBENZ(B,F)AZEPINE AND 5H-DIBENZ(B,F)AZEPINE-5-CARBOXAMIDE | CIBA-GEIGY AG (CH) | 1984-08-15 | — | — | EP | disclosed |
| US-4436660-A | Process for the production of 5-cyano-and 5-carboxamido-5H-dibenz[b,f]azepines | CIBA-GEIGY CORPORATION (US) | 1984-03-13 | — | — | US | disclosed |
| EP-0029409-A1 | Process for preparing 5-cyano-5H-dibenz(b,f)azepine and 5H-dibenz(b,f)azepine-5-carboxamide | CIBA-GEIGY AG (CH) | 1981-05-27 | — | — | EP | disclosed |