Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15975336 | 1.00 | TSHR (0.33) | TSHRMAPK1LMNA | |
| SCHEMBL12163490 | 0.85 | CA2 (0.38) | MAPK1 | |
| SCHEMBL10932492 | 0.82 | TSHR (0.32) | TSHRLMNA | |
| SCHEMBL28470882 | 0.81 | SMPD1 (0.42) | LMNA | |
| SCHEMBL14754924 | 0.79 | THRB (0.39) | MAPK1 | |
| SCHEMBL28860849 | 0.78 | MAPK1 (0.30) | MAPK1 | |
| SCHEMBL12918353 | 0.78 | TSHR (0.32) | TSHRMAPK1 | |
| SCHEMBL754933 | 0.78 | — | — | |
| SCHEMBL14401790 | 0.77 | MAPK1 (0.32) | MAPK1 | |
| SCHEMBL9308935 | 0.77 | TSHR (0.32) | TSHRLMNA |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0024532-B2 | TERT. BUTOXYBUTANALES AND BUTANOLES AND BIS-TERT. BUTOXY-PENTANALES AND PENTANOLES, THEIR PRODUCTION AND THEIR USE AS PERFUMES | BASF Aktiengesellschaft (DE) | 1984-08-15 | — | — | EP | claimed |
| EP-0024532-B1 | TERT. BUTOXYBUTANALES AND BUTANOLES AND BIS-TERT. BUTOXY-PENTANALES AND PENTANOLES, THEIR PRODUCTION AND THEIR USE AS PERFUMES | BASF Aktiengesellschaft (DE) | 1982-06-23 | — | — | EP | claimed |
| CN-103917526-B | Pyrimidine carboxamide derivatives | 南京优迪生物医药有限公司 | 2016-08-24 | — | — | CN | disclosed |
| EP-0300018-B1 | HYDROGENATION PROCESS | DAVY McKEE (LONDON) LIMITED (GB) | 1992-06-17 | — | — | EP | disclosed |
| EP-0319208-B1 | PROCESS FOR HYDROGENATING | DAVY McKEE (LONDON) LIMITED (GB) | 1992-04-15 | — | — | EP | disclosed |
| EP-0319208-A1 | Process for hydrogenating | DAVY McKEE (LONDON) LIMITED (GB) | 1989-06-07 | — | — | EP | disclosed |
| US-4418216-A | Bis-tert.-butoxypentanals and bis-tert.-butoxypentanols | BASF AKTIENGESELLSCHAFT (DE) | 1983-11-29 | — | — | US | disclosed |
| US-4409402-A | FRAGRANCES; CHEMICAL INTERMEDIATES | BASF AKTIENGESELLSCHAFT (DE) | 1983-10-11 | — | — | US | disclosed |
| US-4409402-A | FRAGRANCES; CHEMICAL INTERMEDIATES | BASF AKTIENGESELLSCHAFT (DE) | 1983-10-11 | — | — | US | disclosed |