Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | BTN3A1 | O00481 | 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 | |
|---|---|---|---|---|
| SCHEMBL11029083 | 1.00 | TSHR (0.36) | TSHRALDH1A1ALOX15KDM4EATM | |
| SCHEMBL11136611 | 0.79 | TSHR (0.41) | TSHRALDH1A1ALOX15KDM4EATM | |
| SCHEMBL11136615 | 0.79 | TSHR (0.41) | TSHRALDH1A1ALOX15KDM4EATM | |
| SCHEMBL29067476 | 0.77 | MAPT (0.40) | TSHRALDH1A1KDM4EATM | |
| SCHEMBL8037898 | 0.76 | MAPT (0.38) | TSHRALDH1A1 | |
| SCHEMBL10880110 | 0.73 | ALOX15 (0.38) | ALDH1A1ALOX15KDM4EATMBTN3A1 | |
| SCHEMBL10880108 | 0.73 | ALOX15 (0.38) | ALDH1A1ALOX15KDM4EATMBTN3A1 | |
| SCHEMBL1552504 | 0.73 | TSHR (0.44) | TSHRALDH1A1ALOX15KDM4E | |
| SCHEMBL1552503 | 0.73 | TSHR (0.44) | TSHRALDH1A1ALOX15KDM4E | |
| Urea SCHEMBL11411844 | 0.72 | TSHR (0.41) | TSHRALDH1A1KDM4EATM |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0045861-B1 | UNSATURATED COMPOUNDS, PROCESS FOR THEIR PREPARATION, THEIR USE AS PERFUMES AND THE PERFUMED COMPOSITIONS CONTAINING THEM | L. GIVAUDAN & CIE Société Anonyme (CH) | 1984-10-03 | — | — | EP | claimed |
| US-4426321-A | Odorant alkadienyl ketones, alcohols and oximes | GIVAUDAN CORPORATION (US) | 1984-01-17 | — | — | US | claimed |
| EP-0045861-A2 | Unsaturated compounds, process for their preparation, their use as perfumes and the perfumed compositions containing them | L. GIVAUDAN & CIE Société Anonyme (CH) | 1982-02-17 | — | — | EP | claimed |
| EP-0045861-B1 | UNSATURATED COMPOUNDS, PROCESS FOR THEIR PREPARATION, THEIR USE AS PERFUMES AND THE PERFUMED COMPOSITIONS CONTAINING THEM | L. GIVAUDAN & CIE Société Anonyme (CH) | 1984-10-03 | — | — | EP | disclosed |
| US-4426321-A | Odorant alkadienyl ketones, alcohols and oximes | GIVAUDAN CORPORATION (US) | 1984-01-17 | — | — | US | disclosed |
| EP-0045861-A2 | Unsaturated compounds, process for their preparation, their use as perfumes and the perfumed compositions containing them | L. GIVAUDAN & CIE Société Anonyme (CH) | 1982-02-17 | — | — | EP | disclosed |