Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | UGT1A1 | P22309 | 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 | |
|---|---|---|---|---|
| SCHEMBL10535482 | 1.00 | MEN1 (0.31) | MEN1CYP3A4ALOX15KMT2AMAPT | |
| SCHEMBL16272336 | 0.79 | — | — | |
| SCHEMBL14060590 | 0.79 | — | — | |
| SCHEMBL5059489 | 0.77 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL11363090 | 0.77 | — | — | |
| SCHEMBL9244890 | 0.77 | — | — | |
| SCHEMBL11363098 | 0.77 | — | — | |
| SCHEMBL9244898 | 0.77 | — | — | |
| SCHEMBL11745027 | 0.75 | ALDH1A1 (0.35) | MEN1CYP3A4ALOX15KMT2AMAPT | |
| SCHEMBL18342554 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0235532-B1 | PROCESS FOR THE PREPARATION OF 4-MONOACETALS OF 2-METHYL-2-BUTENE-1,4-DIAL | BASF Aktiengesellschaft (DE) | 1989-06-14 | — | — | EP | disclosed |
| US-4804786-A | HYDROLYSIS OR ALCOHOLYSIS OF BISACETALS IN PRESENCE OF ACID CATALYST | BASF AKTIENGESELLSCHAFT (DE) | 1989-02-14 | — | — | US | disclosed |
| EP-0235532-A1 | Process for the preparation of 4-monoacetals of 2-methyl-2-butene-1,4-dial | BASF Aktiengesellschaft (DE) | 1987-09-09 | — | — | EP | disclosed |
| US-3953524-A | Catalytic hydrogenation of alpha,beta-unsaturated aldehydes to alpha,beta-unsaturated alcohols | HOFFMANN-LA ROCHE INC. (US) | 1976-04-27 | — | — | US | disclosed |