⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14756734 | 1.00 | — | — | |
| SCHEMBL3824801 | 0.88 | KDM4E (0.62) | — | |
| SCHEMBL2827677 | 0.88 | KDM4E (0.62) | — | |
| SCHEMBL14756718 | 0.88 | KDM4E (0.62) | — | |
| SCHEMBL18394618 | 0.86 | POLB (0.54) | — | |
| Hydrochloric Acid SCHEMBL29880849 | 0.86 | KDM4E (0.60) | — | |
| Hydrochloric Acid SCHEMBL15971577 | 0.86 | KDM4E (0.60) | — | |
| Hydrochloric Acid SCHEMBL29880648 | 0.86 | KDM4E (0.60) | — | |
| Hydrochloric Acid SCHEMBL15971806 | 0.86 | KDM4E (0.60) | — | |
| Hydrochloric Acid SCHEMBL28285385 | 0.84 | POLB (0.52) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11298363-B2 | Triazolobenzazepines as vasopressin V1a receptor antagonists | RICHTER GEDEON NYRT. (HU) | 2022-04-12 | — | — | US | disclosed |
| EP-3724192-A1 | TRIAZOLOBENZAZEPINES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS | Richter Gedeon Nyrt. (HU) | 2020-10-21 | — | — | EP | disclosed |
| WO-2019116324-A1 | TRIAZOLOBENZAZEPINES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS | RICHTER GEDEON NYRT. (HU) | 2019-06-20 | — | — | WO | disclosed |
| CN-105873930-B | Novel bicyclic compounds and their use as antibacterial agents and β -lactamase inhibitors | 费多拉制药公司 | 2019-02-19 | — | — | CN | disclosed |
| CN-108884068-A | 1- cyano-pyrolidin derivative as DUB inhibitor | 特殊治疗有限公司 | 2018-11-23 | — | — | CN | disclosed |