⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30992343 | 0.80 | HTR1A (0.53) | — | |
| SCHEMBL13239012 | 0.80 | HTR1A (0.53) | — | |
| SCHEMBL10514753 | 0.79 | — | — | |
| SCHEMBL2545146 | 0.78 | HTR3E (0.56) | — | |
| SCHEMBL10514657 | 0.77 | HTR1A (0.57) | — | |
| Hydrochloric Acid SCHEMBL10523385 | 0.76 | KDM4E (0.57) | — | |
| Hydrochloric Acid SCHEMBL10512938 | 0.76 | — | — | |
| SCHEMBL10512972 | 0.75 | HTR1A (0.52) | — | |
| SCHEMBL10515710 | 0.75 | MTNR1B (0.56) | — | |
| Hydrochloric Acid SCHEMBL10515391 | 0.74 | HTR1A (0.51) | — |
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-0861837-B1 | 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them | SERVIER LAB (FR) | 2004-04-28 | — | — | EP | disclosed |
| US-5968954-A | EXHIBIT SELECTIVE BINDING AFFINITY FOR 5-HYDROXYTRYPTAMINE RECEPTORS | ADIR ET COMPAGNIE (FR) | 1999-10-19 | — | — | US | disclosed |
| EP-0861837-A1 | 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1998-09-02 | — | — | EP | disclosed |