Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | FNTA | P49354 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 10/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 5/20 | 0.40 |
| ▸ | FNTB | P49356 | 1/20 | 0.40 |
| ▸ | BCL2 | P10415 | 7/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28487258 | 1.00 | ALDH1A1 (0.49) | ALDH1A1MEN1KMT2AMAPTFNTA | |
| SCHEMBL7736938 | 0.86 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2AMAPTFNTA | |
| SCHEMBL7729602 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2AMAPTFNTA | |
| SCHEMBL7729596 | 0.82 | MEN1 (0.55) | ALDH1A1MEN1KMT2AMAPTFNTA | |
| SCHEMBL7736963 | 0.81 | MEN1 (0.53) | ALDH1A1MEN1KMT2AMAPTFNTA | |
| SCHEMBL21609555 | 0.81 | MEN1 (0.46) | ALDH1A1MEN1KMT2AMAPTFNTA | |
| SCHEMBL21609551 | 0.81 | MEN1 (0.46) | ALDH1A1MEN1KMT2AMAPTFNTA | |
| SCHEMBL7739476 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2AMAPTFNTA | |
| SCHEMBL19922330 | 0.81 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2AMAPTFNTA | |
| SCHEMBL9414347 | 0.81 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2AMAPTFNTA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3810566-A1 | CYCLOHEXENE PROPANAL DERIVATIVES AS PERFUMING INGREDIENTS | Firmenich SA (CH) | 2021-04-28 | — | — | EP | disclosed |
| WO-2020002212-A1 | CYCLOHEXENE PROPANAL DERIVATIVES AS PERFUMING INGREDIENTS | FIRMENICH SA (CH) | 2020-01-02 | — | — | WO | disclosed |