Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 3/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2286745 | 1.00 | NQO2 (0.46) | NQO2MTNR1AMTNR1BMAPTKDM4E | |
| SCHEMBL5787402 | 0.90 | KDM4E (0.45) | MAPTKDM4ENPC1RAB9AHSD17B10 | |
| SCHEMBL5787405 | 0.90 | KDM4E (0.45) | MAPTKDM4ENPC1RAB9AHSD17B10 | |
| SCHEMBL1401357 | 0.81 | KDM4E (0.50) | NQO2MTNR1AMTNR1BMAPTKDM4E | |
| SCHEMBL1401355 | 0.81 | KDM4E (0.50) | NQO2MTNR1AMTNR1BMAPTKDM4E | |
| SCHEMBL15520897 | 0.77 | CYP2A6 (0.43) | MTNR1AMTNR1BMAPTALDH1A1L3MBTL1 | |
| SCHEMBL15520895 | 0.77 | CYP2A6 (0.43) | MTNR1AMTNR1BMAPTALDH1A1L3MBTL1 | |
| SCHEMBL10044904 | 0.77 | KDM4E (0.46) | MAPTKDM4ENPC1POLBRAB9A | |
| SCHEMBL5785926 | 0.74 | MAOB (0.50) | MAPTKDM4ENPC1RAB9AHSD17B10 | |
| SCHEMBL5785923 | 0.74 | MAOB (0.50) | MAPTKDM4ENPC1RAB9AHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7999129-B2 | Process for the synthesis of (7-methoxy-1-naphthyl) acetonitrile and its application in the synthesis of agomelatine | LES LABORATORIES SERVIER (FR) | 2011-08-16 | — | — | US | disclosed |
| US-7994359-B2 | Process for the synthesis of (7-methoxy-1-naphthyl) acetonitrile and its application in the synthesis of agomelatine | LES LABORATOIRES SERVIER (FR) | 2011-08-09 | — | — | US | disclosed |
| US-5449689-A | Treating melatoninergic system disorders | ADIR ET COMPAGNIE (FR) | 1995-09-12 | — | — | US | disclosed |