⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11064235 | 0.99 | — | — | |
| SCHEMBL10853728 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL10675511 | 0.83 | — | — | |
| SCHEMBL10675587 | 0.83 | — | — | |
| SCHEMBL11349330 | 0.82 | HTR1A (0.67) | — | |
| SCHEMBL11172181 | 0.80 | DRD2 (0.61) | — | |
| SCHEMBL11171863 | 0.78 | DRD2 (0.64) | — | |
| SCHEMBL10779315 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL11263432 | 0.77 | DRD2 (0.64) | — | |
| SCHEMBL10834835 | 0.76 | DRD2 (0.70) | — |
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-4456756-A | PSYCHOTHERAPEUTICS | MEAD JOHNSON & COMPANY (US) | 1984-06-26 | — | — | US | claimed |
| US-4456756-A | PSYCHOTHERAPEUTICS | MEAD JOHNSON & COMPANY (US) | 1984-06-26 | — | — | US | disclosed |
| US-4456756-A | PSYCHOTHERAPEUTICS | MEAD JOHNSON & COMPANY (US) | 1984-06-26 | — | — | US | disclosed |