⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3498038 | 1.00 | — | — | |
| SCHEMBL9731293 | 0.91 | CHRNA7 (0.52) | — | |
| SCHEMBL2229552 | 0.91 | UGCG (0.63) | — | |
| SCHEMBL9443266 | 0.91 | UGCG (0.63) | — | |
| SCHEMBL2229557 | 0.91 | UGCG (0.63) | — | |
| Hydrochloric Acid SCHEMBL7287367 | 0.90 | UGCG (0.62) | — | |
| Hydrochloric Acid SCHEMBL7287361 | 0.90 | UGCG (0.62) | — | |
| Hydrochloric Acid SCHEMBL9602283 | 0.90 | UGCG (0.62) | — | |
| SCHEMBL2228214 | 0.86 | CHRNA7 (0.64) | — | |
| SCHEMBL2228215 | 0.86 | CHRNA7 (0.64) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2344636-B1 | NOVEL CHIMERIC LIGAND-GATED ION CHANNELS AND METHODS OF USE THEREOF | HUGHES HOWARD MED INST (US) | 2017-12-06 | — | — | EP | disclosed |
| EP-2344636-B1 | NOVEL CHIMERIC LIGAND-GATED ION CHANNELS AND METHODS OF USE THEREOF | HUGHES HOWARD MED INST (US) | 2017-12-06 | — | — | EP | disclosed |
| US-8435762-B2 | Chimeric ligand-gated ion channels and methods of use thereof | HOWARD HUGHES MEDICAL INSTITUTE (US) | 2013-05-07 | — | — | US | disclosed |
| US-20100130420-A1 | NOVEL CHIMERIC LIGAND-GATED ION CHANNELS AND METHODS OF USE THEREOF | HOWARD HUGHES MEDICAL INSTITUTE (US) | 2010-05-27 | — | — | US | disclosed |