Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL1151710 | 0.79 | — | — | |
| SCHEMBL8679785 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHRTDP1 | |
| SCHEMBL503396 | 0.78 | — | — | |
| SCHEMBL6223 | 0.78 | — | — | |
| Acetone SCHEMBL1822236 | 0.77 | ALDH1A1 (0.61) | ALDH1A1TSHRTDP1 | |
| SCHEMBL9109031 | 0.77 | TSHR (0.61) | ALDH1A1TSHRTDP1 | |
| SCHEMBL29030569 | 0.77 | TSHR (0.61) | ALDH1A1TSHRTDP1 | |
| Tert-Butyl Hydroperoxide SCHEMBL9109021 | 0.77 | ALDH1A1 (0.69) | ALDH1A1TSHRTDP1 | |
| Tert-Butanol SCHEMBL4334103 | 0.75 | ALDH1A1 (0.73) | ALDH1A1TSHRTDP1 | |
| Methyl Alcohol SCHEMBL15124588 | 0.75 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5220078-A | Catalyst selectivity | TEXACO CHEMICAL COMPANY (US) | 1993-06-15 | — | — | US | claimed |
| CN-109867583-B | Process for obtaining 2,4, 4-trimethyl-1-pentene from carbon tetra-laminated oil | 丹东明珠特种树脂有限公司 | 2022-02-18 | — | — | CN | disclosed |
| US-5583086-A | CATALYST SELECTIVITY | BASF AKTIENGESELLSCHAFT (DE) | 1996-12-10 | — | — | US | disclosed |
| US-5313006-A | Cogeneration of isobutylene plus MTBE from crude t-butanol/methanol feedstocks | TEXACO CHEMICAL COMPANY (US) | 1994-05-17 | — | — | US | disclosed |
| US-5099072-A | Dehydration reaction of tert-butyl alcohol with methanol in the presence of montmorillonite clay catalyst | TEXACO CHEMICAL COMPANY (US) | 1992-03-24 | — | — | US | disclosed |