Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NAAA | Q02083 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18439 | 1.00 | EPHX1 (0.45) | EPHX1SMN1; SMN2NAAAALDH1A1HPGD | |
| SCHEMBL8896243 | 1.00 | EPHX1 (0.45) | EPHX1SMN1; SMN2NAAAALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL28284486 | 0.98 | EPHX1 (0.44) | EPHX1SMN1; SMN2NAAAALDH1A1HPGD | |
| SCHEMBL8894777 | 0.98 | EPHX1 (0.42) | EPHX1SMN1; SMN2NAAAALDH1A1HPGD | |
| SCHEMBL29153766 | 0.94 | ALDH1A1 (0.41) | EPHX1SMN1; SMN2NAAAALDH1A1HPGD | |
| SCHEMBL12506840 | 0.89 | — | — | |
| SCHEMBL6931991 | 0.88 | SMN1; SMN2 (0.56) | EPHX1SMN1; SMN2NAAAALDH1A1CYP1A2 | |
| SCHEMBL19842292 | 0.88 | SMN1; SMN2 (0.56) | EPHX1SMN1; SMN2NAAAALDH1A1CYP1A2 | |
| SCHEMBL28379526 | 0.87 | SMN1; SMN2 (0.46) | EPHX1SMN1; SMN2NAAAALDH1A1HPGD | |
| Butyric Acid SCHEMBL28983071 | 0.87 | LMNA (0.45) | EPHX1SMN1; SMN2ALDH1A1CYP1A2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-119213108-A | 2-Cyclooctyl ethyl acetate as fragrance | 西姆莱斯股份公司 | 2024-12-27 | — | — | CN | claimed |
| CN-119213108-A | 2-Cyclooctyl ethyl acetate as fragrance | 西姆莱斯股份公司 | 2024-12-27 | — | — | CN | disclosed |
| CN-114394960-B | Dibenzocyclooctyne-tetra polyethylene glycol-active ester compound, preparation method and application | 宜昌博仁凯润药业有限公司 | 2023-04-28 | — | — | CN | disclosed |
| CN-114394960-A | Dibenzocyclooctyne-tetraethylene glycol-active ester compound, preparation method and application | 宜昌博仁凯润药业有限公司 | 2022-04-26 | — | — | CN | disclosed |
| CN-114181228-A | Cleavable DdeBiotin-PEG4-DBCO compound, preparation method and application thereof | 宜昌博仁凯润药业有限公司 | 2022-03-15 | — | — | CN | disclosed |
| CN-114106012-A | Compound Biotin-PEG3-SS-DBCO, preparation method and application thereof | 宜昌博仁凯润药业有限公司 | 2022-03-01 | — | — | CN | disclosed |