Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 6/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11538594 | 0.89 | HTT (0.58) | LTA4HKDM4EGAADRD2POLB | |
| SCHEMBL11540482 | 0.84 | DRD2 (0.45) | KDM4EGAADRD2POLBHTT | |
| SCHEMBL11537590 | 0.81 | KDM4E (0.45) | LTA4HKDM4EGAADRD2POLB | |
| SCHEMBL11535925 | 0.81 | ALDH1A1 (0.42) | LTA4HDRD2POLBHPGDALDH1A1 | |
| Hydrochloric Acid SCHEMBL11534191 | 0.80 | DRD2 (0.71) | LTA4HDRD2TSHR | |
| SCHEMBL11537350 | 0.79 | LTA4H (0.59) | LTA4HKDM4EGAADRD2POLB | |
| Hydrochloric Acid SCHEMBL11540300 | 0.78 | LTA4H (0.58) | LTA4HDRD2POLBHTT | |
| SCHEMBL11536925 | 0.77 | LTA4H (0.57) | LTA4HDRD2HTT | |
| SCHEMBL4553361 | 0.74 | HTT (0.71) | POLBHTTHPGDALDH1A1TSHR | |
| SCHEMBL10760411 | 0.71 | OPRM1 (0.66) | DRD2POLBALDH1A1 |
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-4140781-A | Analgesic and neuraleptic 2-piperidinoalkyl-1,4-benzodioxans | CIBA-GEIGY CORPORATION (US) | 1979-02-20 | — | — | US | disclosed |
| US-4129655-A | Neuroleptic 2-piperidinoalkyl-1,4-benzodioxans | CIBA-GEIGY CORPORATION (US) | 1978-12-12 | — | — | US | disclosed |
| US-4104396-A | NEUROLEPTIC, ANALGESIC | CIBA-GEIGY CORPORATION (US) | 1978-08-01 | — | — | US | disclosed |
| US-4039676-A | NEUROLEPTIC AGENTS | CIBA-GEIGY CORPORATION (US) | 1977-08-02 | — | — | US | disclosed |