Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27921361 | 0.98 | TDP1 (0.39) | TDP1DGAT1CYP2D6CA12CA14 | |
| SCHEMBL1263607 | 0.96 | TDP1 (0.38) | TDP1DGAT1CYP2D6CA12CA14 | |
| SCHEMBL2648388 | 0.87 | DGAT1 (0.42) | TDP1DGAT1CYP2D6CA12CA14 | |
| SCHEMBL28129232 | 0.87 | MGAM (0.54) | TDP1DGAT1CYP2D6CA12CA14 | |
| SCHEMBL12735830 | 0.85 | TDP1 (0.36) | TDP1DGAT1CYP2D6CA12CA14 | |
| SCHEMBL28110392 | 0.84 | GAA (0.45) | GAACTSKMGAMSIMGAM2 | |
| SCHEMBL6415291 | 0.82 | ALDH1A1 (0.41) | DGAT1CYP2D6CA12CA14CA1 | |
| SCHEMBL241533 | 0.82 | DGAT1 (0.46) | TDP1DGAT1CYP2D6CA12CA14 | |
| SCHEMBL10833684 | 0.81 | TDP1 (0.38) | TDP1DGAT1CYP2D6CA12CA14 | |
| SCHEMBL29438012 | 0.80 | DGAT1 (0.41) | TDP1DGAT1CYP2D6CA12CA14 |
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 237 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118638002-A | Preparation method of sodium valproate toxic metabolite 2-propyl-4-pentenoic acid | 湖南大学 | 2024-09-13 | — | — | CN | claimed |
| CN-116947600-B | Preparation method of 2-isopropyl valeric acid as valproic acid process impurity | 湖南省湘中制药有限公司 | 2024-04-26 | — | — | CN | claimed |
| CN-116874347-B | Preparation method of impurity dipropylvaleric acid in valproic acid process | 湖南省湘中制药有限公司 | 2024-03-29 | — | — | CN | claimed |
| CN-116947600-A | Preparation method of 2-isopropyl valeric acid as valproic acid process impurity | 湖南省湘中制药有限公司 | 2023-10-27 | — | — | CN | claimed |
| CN-116874347-A | Preparation method of impurity dipropylvaleric acid in valproic acid process | 湖南省湘中制药有限公司 | 2023-10-13 | — | — | CN | claimed |
| US-20230167310-A1 | CURING CATALYST AND RESIN COMPOSITION | KOEI CHEMICAL COMPANY, LIMITED (JP) | 2023-06-01 | — | — | US | claimed |
| EP-4144436-A1 | CURING CATALYST AND RESIN COMPOSITION | Koei Chemical Company, Limited (JP) | 2023-03-08 | — | — | EP | claimed |
| CN-115461147-A | Curing catalyst and resin composition | 广荣化学株式会社 | 2022-12-09 | — | — | CN | claimed |
| US-7560550-B2 | Method for the production of OH protected[4-(2.6-diamino-9H-purine-9-yl)-1.3-dioxolane-2-yl]methanol derivatives | RFS PHARMA, LLC (US) | 2009-07-14 | — | — | US | claimed |
| CN-114930211-B | Method for manufacturing polarizing film | 日东电工株式会社 | 2024-10-29 | — | — | CN | disclosed |
| CN-118638002-A | Preparation method of sodium valproate toxic metabolite 2-propyl-4-pentenoic acid | 湖南大学 | 2024-09-13 | — | — | CN | disclosed |
| CN-112444906-B | Method for manufacturing polarizing film | 日东电工株式会社 | 2024-07-26 | — | — | CN | disclosed |
| CN-112444904-B | Method for manufacturing polarizing film | 日东电工株式会社 | 2024-07-02 | — | — | CN | disclosed |
| CN-116947600-B | Preparation method of 2-isopropyl valeric acid as valproic acid process impurity | 湖南省湘中制药有限公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-1141294-A | Method for prepn. of isoxazoles herbicides | RHONE POULENC AGRICULTURE (GB) | 1997-01-29 | — | — | CN | disclosed |
| EP-0418175-B1 | Isoxazoles herbicides | RHONE POULENC AGRICULTURE (GB) | 1996-07-17 | — | — | EP | disclosed |
| EP-0254578-B1 | ANTIBIOTIC INTERMEDIATES | ELI LILLY AND COMPANY (US) | 1993-09-08 | — | — | EP | disclosed |
| CN-1050188-A | ISOXAZOLES HERBICIDES | RHONE POULENC AGRICULTURE (GB) | 1991-03-27 | — | — | CN | disclosed |
| EP-0418175-A2 | Isoxazoles herbicides | RHONE POULENC AGRICULTURE LTD. (GB) | 1991-03-20 | — | — | EP | disclosed |
| US-4772694-A | Chiral 3-(1,2,5-trisubstituted imidazolidinone) azetidinone antibiotic intermediates | ELI LILLY AND COMPANY (US) | 1988-09-20 | — | — | US | disclosed |