Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HMGCR | P04035 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL29134691 | 0.89 | TSHR (0.36) | TSHRALDH1A1HMGCRCHRM1TBXA2R | |
| SCHEMBL6598371 | 0.78 | ALDH1A1 (0.45) | TSHRALDH1A1HMGCRCHRM1TBXA2R | |
| SCHEMBL10802968 | 0.76 | TSHR (0.43) | TSHRALDH1A1HMGCRCHRM1TBXA2R | |
| SCHEMBL7087814 | 0.76 | HMGCR (0.55) | TSHRALDH1A1HMGCRCHRM1TBXA2R | |
| SCHEMBL6937150 | 0.74 | TSHR (0.40) | TSHRALDH1A1HMGCRCHRM1TBXA2R | |
| SCHEMBL29048874 | 0.74 | CA4 (0.37) | TSHRFFAR3 | |
| SCHEMBL7192471 | 0.74 | ALDH1A1 (0.41) | TSHRALDH1A1HMGCRCHRM1TBXA2R | |
| SCHEMBL29789023 | 0.74 | ACLY (0.43) | TSHRALDH1A1HMGCRCHRM1TBXA2R | |
| SCHEMBL5277664 | 0.72 | TSHR (0.38) | TSHRALDH1A1HMGCRCHRM1TBXA2R | |
| SCHEMBL10830599 | 0.72 | TSHR (0.38) | TSHRALDH1A1HMGCRCHRM1TBXA2R |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110790666-B | Preparation method of ethyl 2,2, 4-trimethyl-3-hydroxypentanoate, water-based paint for containers and preparation method of water-based paint | 润泰化学（泰兴）有限公司 | 2022-05-03 | — | — | CN | claimed |
| CN-110724055-B | Preparation method of n-butyl 2,2, 4-trimethyl-3-hydroxypentanoate, latex paint and preparation method thereof | 润泰化学（泰兴）有限公司 | 2022-05-03 | — | — | CN | claimed |
| CN-110803988-B | Preparation method of 2,2, 4-trimethyl-3-hydroxypentanoic acid methoxyethyl ester, aqueous wood lacquer and preparation method thereof | 润泰化学（泰兴）有限公司 | 2022-05-03 | — | — | CN | claimed |
| CN-110746298-B | Preparation method of isobutyl 2,2, 4-trimethyl-3-hydroxypentanoate, really stone paint and preparation method thereof | 润泰化学（泰兴）有限公司 | 2022-05-03 | — | — | CN | claimed |
| CN-110803988-A | Preparation method of 2,2, 4-trimethyl-3-hydroxypentanoic acid methoxyethyl ester, aqueous wood lacquer and preparation method thereof | 润泰化学（泰兴）有限公司 | 2020-02-18 | — | — | CN | claimed |
| CN-113735704-B | Method for simultaneously synthesizing dodecanol ester and hexadecyl diester | 润泰新材料股份有限公司 | 2024-03-08 | — | — | CN | disclosed |
| CN-113121344-B | Process for washing crude 2, 4-trimethyl-1, 3-pentanediol monoisobutyrate | 南京工业大学 | 2023-08-08 | — | — | CN | disclosed |
| CN-110724055-B | Preparation method of n-butyl 2,2, 4-trimethyl-3-hydroxypentanoate, latex paint and preparation method thereof | 润泰化学（泰兴）有限公司 | 2022-05-03 | — | — | CN | disclosed |
| CN-110790666-B | Preparation method of ethyl 2,2, 4-trimethyl-3-hydroxypentanoate, water-based paint for containers and preparation method of water-based paint | 润泰化学（泰兴）有限公司 | 2022-05-03 | — | — | CN | disclosed |
| CN-110803988-B | Preparation method of 2,2, 4-trimethyl-3-hydroxypentanoic acid methoxyethyl ester, aqueous wood lacquer and preparation method thereof | 润泰化学（泰兴）有限公司 | 2022-05-03 | — | — | CN | disclosed |
| CN-110746298-B | Preparation method of isobutyl 2,2, 4-trimethyl-3-hydroxypentanoate, really stone paint and preparation method thereof | 润泰化学（泰兴）有限公司 | 2022-05-03 | — | — | CN | disclosed |
| CN-110746297-B | Preparation method of 2,2, 4-trimethyl-3-hydroxy methyl valerate, water-based industrial paint for steel structure and preparation method of water-based industrial paint | 润泰化学（泰兴）有限公司 | 2022-05-03 | — | — | CN | disclosed |
| CN-212924436-U | Dodecanol ester process wastewater treatment system | 润泰化学（泰兴）有限公司 | 2021-04-09 | — | — | CN | disclosed |
| CN-110803988-A | Preparation method of 2,2, 4-trimethyl-3-hydroxypentanoic acid methoxyethyl ester, aqueous wood lacquer and preparation method thereof | 润泰化学（泰兴）有限公司 | 2020-02-18 | — | — | CN | disclosed |
| CN-110790666-A | Preparation method of ethyl 2,2, 4-trimethyl-3-hydroxypentanoate, water-based paint for containers and preparation method of water-based paint | 润泰化学（泰兴）有限公司 | 2020-02-14 | — | — | CN | disclosed |
| CN-110746297-A | Preparation method of 2,2, 4-trimethyl-3-hydroxy methyl valerate, water-based industrial paint for steel structure and preparation method of water-based industrial paint | 润泰化学（泰兴）有限公司 | 2020-02-04 | — | — | CN | disclosed |
| CN-110746298-A | Preparation method of isobutyl 2,2, 4-trimethyl-3-hydroxypentanoate, really stone paint and preparation method thereof | 润泰化学（泰兴）有限公司 | 2020-02-04 | — | — | CN | disclosed |
| CN-110724055-A | Preparation method of n-butyl 2,2, 4-trimethyl-3-hydroxypentanoate, latex paint and preparation method thereof | 润泰化学（泰兴）有限公司 | 2020-01-24 | — | — | CN | disclosed |
| EP-0005471-B1 | PROCESS FOR THE PREPARATION OF 2,2,4-TRIMETHYL-3-HYDROXYPENTYL-ISOBUTYRATE | BASF Aktiengesellschaft (DE) | 1981-09-09 | — | — | EP | disclosed |
| EP-0005471-A2 | Process for the preparation of 2,2,4-trimethyl-3-hydroxypentyl-isobutyrate | BASF Aktiengesellschaft (DE) | 1979-11-28 | — | — | EP | disclosed |