⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8887343 | 0.90 | MAP3K14 (0.41) | — | |
| SCHEMBL8887058 | 0.84 | TRPM4 (0.48) | — | |
| SCHEMBL8887938 | 0.84 | TRPM5 (0.44) | — | |
| SCHEMBL8887332 | 0.84 | — | — | |
| SCHEMBL8885782 | 0.83 | DRD2 (0.46) | — | |
| SCHEMBL5709363 | 0.82 | SLC6A2 (0.37) | — | |
| SCHEMBL5709356 | 0.81 | — | — | |
| SCHEMBL7320995 | 0.81 | — | — | |
| SCHEMBL8886689 | 0.81 | SLC6A2 (0.50) | — | |
| SCHEMBL27680712 | 0.79 | TRPM5 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5643784-A | TREATMENT OF ANXIETY, DEPRESSION, SLEEPING DISORDERS, SCHIZOPHRENIA AND MIGRAINE | H, LUNDBECK A/S (DK) | 1997-07-01 | — | — | US | disclosed |
| EP-0560868-B1 | INDAN DERIVATIVES | LUNDBECK & CO AS H (DK) | 1995-04-19 | — | — | EP | disclosed |
| EP-0560868-A1 | INDAN DERIVATIVES. | LUNDBECK & CO AS H (DK) | 1993-09-22 | — | — | EP | disclosed |
| WO-1992010192-A1 | INDAN DERIVATIVES | H. LUNDBECK A/S (DK) | 1992-06-25 | — | — | WO | disclosed |