⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2809595 | 0.82 | — | — | |
| SCHEMBL27625038 | 0.78 | — | — | |
| SCHEMBL7370699 | 0.78 | — | — | |
| SCHEMBL3045246 | 0.78 | — | — | |
| SCHEMBL533253 | 0.78 | — | — | |
| SCHEMBL7367223 | 0.78 | TAAR1 (0.36) | — | |
| SCHEMBL15013570 | 0.75 | — | — | |
| SCHEMBL533287 | 0.75 | KCNH2 (0.38) | — | |
| SCHEMBL28315278 | 0.75 | NOS3 (0.39) | — | |
| SCHEMBL533691 | 0.74 | KCNH2 (0.46) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6680314-B2 | USEFUL FOR THE TREATMENT OF DISEASES INVOLVING THE CHOLINERGIC SYSTEM OF THE CENTRAL NERVOUS SYSTEM, PAIN, INFLAMMATORY DISEASES, DISEASES CAUSED BY SMOOTH MUSCLE CONTRACTIONS, LEARNING DEFICIT, COGNITION DEFICIT, ATTENTION DEFICIT | NEUROSEARCH A/S (DK) | 2004-01-20 | — | — | US | claimed |
| CN-1124266-C | Azacyclooctane and heptane derivatives, their preparation and usein therapy | NEUROSEACH AS (DK) | 2003-10-15 | — | — | CN | claimed |
| EP-0984943-B1 | AZACYCLOOCTANE AND HEPTANE DERIVATIVES, THEIR PREPARATION AND USEIN THERAPY | NEUROSEARCH AS (DK) | 2002-12-11 | — | — | EP | claimed |
| US-20020169156-A1 | Azacyclooctane and heptane derivatives, their preparation and use in therapy | NEUROSEARCH A/S | 2002-11-14 | — | — | US | claimed |
| US-6420395-B1 | DISORDERS OR DISEASES INVOLVING THE CHOLINERGIC SYSTEM OF THE CENTRAL NERVOUS SYSTEM, PAIN, INFLAMMATORY DISEASES, DISEASES CAUSED BY SMOOTH MUSCLE CONTRACTIONS AND AS ASSISTANCE IN THE CESSATION OF CHEMICAL SUBSTANCE ABUSE. | NEUROSEARCH A/S (DK) | 2002-07-16 | — | — | US | claimed |
| CN-1257485-A | Azacyclooctane and heptane derivatives, their preparation and usein therapy | NEUROSEACH A S (DK) | 2000-06-21 | — | — | CN | claimed |
| EP-0984943-A1 | AZACYCLOOCTANE AND HEPTANE DERIVATIVES, THEIR PREPARATION AND USEIN THERAPY | NEUROSEARCH A/S (DK) | 2000-03-15 | — | — | EP | claimed |
| WO-1998054152-A1 | AZACYCLOOCTANE AND HEPTANE DERIVATIVES, THEIR PREPARATION AND USEIN THERAPY | NEUROSEARCH A/S (DK) | 1998-12-03 | — | — | WO | claimed |
| US-6680314-B2 | USEFUL FOR THE TREATMENT OF DISEASES INVOLVING THE CHOLINERGIC SYSTEM OF THE CENTRAL NERVOUS SYSTEM, PAIN, INFLAMMATORY DISEASES, DISEASES CAUSED BY SMOOTH MUSCLE CONTRACTIONS, LEARNING DEFICIT, COGNITION DEFICIT, ATTENTION DEFICIT | NEUROSEARCH A/S (DK) | 2004-01-20 | — | — | US | disclosed |
| CN-1124266-C | Azacyclooctane and heptane derivatives, their preparation and usein therapy | NEUROSEACH AS (DK) | 2003-10-15 | — | — | CN | disclosed |
| EP-0984943-B1 | AZACYCLOOCTANE AND HEPTANE DERIVATIVES, THEIR PREPARATION AND USEIN THERAPY | NEUROSEARCH AS (DK) | 2002-12-11 | — | — | EP | disclosed |
| US-20020169156-A1 | Azacyclooctane and heptane derivatives, their preparation and use in therapy | NEUROSEARCH A/S | 2002-11-14 | — | — | US | disclosed |
| US-6420395-B1 | DISORDERS OR DISEASES INVOLVING THE CHOLINERGIC SYSTEM OF THE CENTRAL NERVOUS SYSTEM, PAIN, INFLAMMATORY DISEASES, DISEASES CAUSED BY SMOOTH MUSCLE CONTRACTIONS AND AS ASSISTANCE IN THE CESSATION OF CHEMICAL SUBSTANCE ABUSE. | NEUROSEARCH A/S (DK) | 2002-07-16 | — | — | US | disclosed |
| CN-1257485-A | Azacyclooctane and heptane derivatives, their preparation and usein therapy | NEUROSEACH A S (DK) | 2000-06-21 | — | — | CN | disclosed |