Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | TLR4 | O00206 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL17656195 | 1.00 | KMT2A (0.39) | KMT2ACA1CA2CA4TLR4 | |
| SCHEMBL927321 | 0.88 | KMT2A (0.48) | KMT2ACA1CA2CA4TLR4 | |
| SCHEMBL7911393 | 0.88 | KMT2A (0.48) | KMT2ACA1CA2CA4TLR4 | |
| SCHEMBL2487746 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL2187101 | 0.84 | CA1 (0.44) | KMT2ACA1CA2CA4TLR4 | |
| SCHEMBL1325684 | 0.80 | — | — | |
| Sulfurous Acid SCHEMBL8579288 | 0.76 | CA1 (0.38) | KMT2ACA1CA2CA4TLR4 | |
| SCHEMBL2193109 | 0.73 | KMT2A (0.42) | KMT2ACA1CA2CA4TLR4 | |
| SCHEMBL2196527 | 0.73 | KMT2A (0.42) | KMT2ACA1CA2CA4TLR4 | |
| SCHEMBL2193711 | 0.73 | KMT2A (0.42) | KMT2ACA1CA2CA4TLR4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016050836-A1 | USE OF NOVEL CYCLIC CARBALDEYDES AS AN AROMATIC SUBSTANCE | BASF SE (DE) | 2016-04-07 | — | — | WO | disclosed |
| EP-3002003-A1 | Use of a novel cyclic carbaldehyde as an aromatic material | BASF SE (DE) | 2016-04-06 | — | — | EP | disclosed |