Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 16/20 | 0.49 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL10460567 | 0.83 | ACHE (0.48) | ACHE | |
| SCHEMBL9628413 | 0.82 | BCHE (0.46) | ACHE | |
| Oxalic Acid SCHEMBL9628716 | 0.81 | ACHE (0.46) | ACHE | |
| SCHEMBL9628688 | 0.80 | HTR2B (0.43) | MTNR1A | |
| SCHEMBL9628703 | 0.78 | ACHE (0.45) | ACHE | |
| SCHEMBL9628089 | 0.78 | ACHE (0.41) | ACHEMTNR1AMTNR1B | |
| SCHEMBL9628742 | 0.75 | TP53 (0.41) | ACHE | |
| Oxalic Acid SCHEMBL9628990 | 0.75 | ACHE (0.39) | ACHEMTNR1AMTNR1B | |
| SCHEMBL9627834 | 0.75 | DRD3 (0.45) | — | |
| SCHEMBL9627777 | 0.74 | PPARG (0.37) | ACHEMTNR1AMTNR1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0281261-B1 | 3-AMINOMETHYL DERIVATIVES OF INDANE, INDOLINE AND DIHYDROBENZOFURANE AND DIHYDROBENZOTHIOPHENE | H. LUNDBECK A/S (DK) | 1992-05-06 | — | — | EP | disclosed |
| US-4946863-A | CNS-affecting 6-oxy-3-aminomethyl indanes, compositions thereof, and method of treating therewith | H. LUNDBECK A/S (DK) | 1990-08-07 | — | — | US | disclosed |
| US-4847254-A | CNS affecting 5-oxy-3-aminomethyl-dihydro-benzofurans and benzothiophenes | H. LUNDBECK A/S (DK) | 1989-07-11 | — | — | US | disclosed |
| EP-0281261-A2 | 3-Aminomethyl derivatives of indane, indoline and dihydrobenzofurane and dihydrobenzothiophene | H. LUNDBECK A/S (DK) | 1988-09-07 | — | — | EP | disclosed |