⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27835768 | 0.64 | — | — | |
| SCHEMBL7360580 | 0.61 | — | — | |
| SCHEMBL24916721 | 0.60 | — | — | |
| Water SCHEMBL28166230 | 0.58 | — | — | |
| Hydrochloric Acid SCHEMBL4696764 | 0.58 | — | — | |
| SCHEMBL25201264 | 0.58 | CA1 (0.32) | — | |
| SCHEMBL28208254 | 0.57 | — | — | |
| SCHEMBL7507421 | 0.56 | — | — | |
| SCHEMBL19067974 | 0.56 | — | — | |
| SCHEMBL10921193 | 0.56 | — | — |
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-5789402-A | Compounds having effects on serotonin-related systems | ELI LILLY COMPANY (US) | 1998-08-04 | — | — | US | disclosed |
| US-5741789-A | HETERO-OXY ALKANAMINES | ELI LILLY AND COMPANY (US) | 1998-04-21 | — | — | US | disclosed |