⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18392622 | 1.00 | — | — | |
| SCHEMBL825641 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL20703786 | 0.97 | — | — | |
| SCHEMBL4011523 | 0.83 | — | — | |
| SCHEMBL131495 | 0.79 | — | — | |
| SCHEMBL7749465 | 0.78 | DNM1 (0.37) | — | |
| SCHEMBL28028448 | 0.78 | DNM1 (0.32) | — | |
| SCHEMBL8351515 | 0.77 | — | — | |
| SCHEMBL17683796 | 0.77 | — | — | |
| SCHEMBL10730624 | 0.77 | — | — |
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-9012644-B2 | Compounds having muscarinic receptor antagonist and beta2 adrenergic receptor agonist activity | CHIESI FARMACEUTICI S.P.A. (IT) | 2015-04-21 | — | — | US | disclosed |
| US-20130034504-A1 | COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY | CHIESI FARMACEUTICI S.P.A. (IT) | 2013-02-07 | — | — | US | disclosed |