Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 8/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 10/20 | 0.45 |
| ▸ | NQO2 | P16083 | 9/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 9/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9628952 | 0.81 | ACHE (0.66) | ACHEMTNR1ANQO2MTNR1B | |
| SCHEMBL9628446 | 0.77 | ESR1 (0.57) | MTNR1ANQO2MTNR1B | |
| SCHEMBL13853634 | 0.77 | ACHE (0.70) | ACHE | |
| SCHEMBL10552862 | 0.76 | BCHE (0.49) | ACHEMTNR1ANQO2MTNR1B | |
| SCHEMBL9628081 | 0.76 | ACHE (0.60) | ACHE | |
| SCHEMBL2947131 | 0.75 | MTNR1A (0.41) | ACHEMTNR1ANQO2MTNR1B | |
| Hydrochloric Acid SCHEMBL1644618 | 0.74 | ACHE (0.41) | ACHEMTNR1ANQO2MTNR1B | |
| SCHEMBL9627778 | 0.73 | MCHR1 (0.48) | ACHEMTNR1ANQO2MTNR1B | |
| SCHEMBL9628146 | 0.73 | ACHE (0.45) | ACHEMTNR1ANQO2MTNR1B | |
| SCHEMBL9629884 | 0.73 | ACHE (0.45) | ACHEMTNR1ANQO2MTNR1B |
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 |