Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 5/20 | 0.36 |
| ▸ | SPHK2 | Q9NRA0 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | RAD52 | P43351 | 1/20 | 0.30 |
| ▸ | EBP | Q15125 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL32678430 | 0.85 | EPHX1 (0.36) | EPHX1 | |
| SCHEMBL32678431 | 0.85 | EPHX1 (0.36) | EPHX1 | |
| SCHEMBL238100 | 0.85 | EPHX1 (0.36) | EPHX1 | |
| SCHEMBL238101 | 0.85 | EPHX1 (0.36) | EPHX1 | |
| SCHEMBL19924614 | 0.85 | EPHX1 (0.36) | EPHX1 | |
| SCHEMBL5157013 | 0.85 | EPHX1 (0.36) | EPHX1 | |
| SCHEMBL238102 | 0.85 | EPHX1 (0.36) | EPHX1 | |
| SCHEMBL11251244 | 0.82 | EPHX1 (0.53) | EPHX1ALDH1A1CYP1A2SPHK1SPHK2 | |
| SCHEMBL11245616 | 0.81 | EPHX1 (0.52) | EPHX1ALDH1A1CYP1A2SPHK1SPHK2 | |
| SCHEMBL11241826 | 0.77 | EPHX1 (0.52) | EPHX1ALDH1A1CYP1A2SPHK1SPHK2 |
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-4364400-A | 1,3-OXATHIANE AND 1,3-OXATHIOLANE DERIVATIVES | FIRMENICH SA (CH) | 1982-12-21 | — | — | US | disclosed |
| US-4262030-A | 1,3-OXATHIANE AND 1,3-OXATHIOLANE DERIVATIVES | FIRMENICH SA (CH) | 1981-04-14 | — | — | US | disclosed |
| US-4220561-A | Oxathiane and oxathiolane derivatives as perfuming agents | FIRMENICH SA (CH) | 1980-09-02 | — | — | US | disclosed |