⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5110718 | 0.88 | MAOA (0.31) | — | |
| SCHEMBL7247983 | 0.88 | — | — | |
| SCHEMBL7246152 | 0.88 | KCNA5 (0.33) | — | |
| SCHEMBL5096952 | 0.85 | HRH4 (0.33) | — | |
| SCHEMBL7249254 | 0.85 | — | — | |
| SCHEMBL5110872 | 0.85 | — | — | |
| SCHEMBL5104184 | 0.84 | HRH4 (0.39) | — | |
| SCHEMBL5096783 | 0.83 | HRH4 (0.38) | — | |
| SCHEMBL676980 | 0.83 | — | — | |
| SCHEMBL7250854 | 0.83 | BCHE (0.31) | — |
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-7348326-B2 | Heteroaryl fused aminoalkyl imidazole derivatives: selective modulators of GABAa receptors | NEUROGEN CORPORATION (US) | 2008-03-25 | — | — | US | disclosed |
| US-20060160842-A1 | Heteroaryl fused aminoalkyl imidazole derivates: selective modulators of GABAA receptors | NEUROGEN CORPORATION (US) | 2006-07-20 | — | — | US | disclosed |
| US-6972293-B2 | Heteroaryl fused aminoalkyl-imidazole derivatives: selective modulators of GABAa receptors | NEUROGEN CORPORATION (US) | 2005-12-06 | — | — | US | disclosed |
| US-6627624-B1 | Agonists, antagonists or inverse agonists for GABAa brain receptors or prodrugs of agonists, antagonists or inverse agonists for GABAa brain receptors, and are therefore useful in the diagnosis and treatment of anxiety, Down Syndrome, | NEUROGEN CORPORATION | 2003-09-30 | — | — | US | disclosed |
| US-6380210-B1 | USEFUL IN DIAGNOSIS AND TREATMENT OF ANXIETY, DOWN SYNDROME, SLEEP, COGNITIVE AND SEIZURE DISORDERS, DEPRESSION, OVERDOSE WITH BENZODIAZEPINE DRUGS, AND ENHANCEMENT OF MEMORY AND ALERTNESS | NEUROGEN CORPORATION | 2002-04-30 | — | — | US | disclosed |