Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MIF | P14174 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30594257 | 0.79 | MAOB (0.39) | ALDH1A1RAB9ASMN1; SMN2KDM4ENPC1 | |
| SCHEMBL20291773 | 0.75 | SMN1; SMN2 (0.46) | ALDH1A1RAB9ASMN1; SMN2KDM4ENPC1 | |
| SCHEMBL667853 | 0.75 | ESR1 (0.42) | ALDH1A1RAB9ASMN1; SMN2NPC1MAPT | |
| SCHEMBL6070922 | 0.74 | — | — | |
| SCHEMBL10585825 | 0.70 | PTGS2 (0.45) | ALDH1A1RAB9ASMN1; SMN2KDM4ENPC1 | |
| SCHEMBL24035501 | 0.70 | MKNK1 (0.37) | — | |
| SCHEMBL15664958 | 0.68 | CHRNB4 (0.50) | CLK4ALDH1A1RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL14373829 | 0.68 | NOTUM (0.62) | ALDH1A1RAB9ASMN1; SMN2KDM4ENPC1 | |
| SCHEMBL19873011 | 0.68 | MIF (0.57) | RAB9ASMN1; SMN2NPC1MIF | |
| SCHEMBL31069019 | 0.68 | CHEK2 (0.37) | ALDH1A1RAB9ASMN1; SMN2KDM4ENPC1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112004805-B | Process for producing 5, 5-disubstituted-4, 5-dihydroisoxazoles | 组合化学工业株式会社 | 2024-06-14 | — | — | CN | disclosed |
| CN-117396464-A | Process for producing aldehyde compound and dihydroisoxazole compound | 组合化学工业株式会社 | 2024-01-12 | — | — | CN | disclosed |
| CN-111491926-B | Novel method for producing 5, 5-disubstituted-4, 5-dihydroisoxazole | 组合化学工业株式会社 | 2022-07-15 | — | — | CN | disclosed |
| CN-113891882-A | Method for producing dihydroisoxazole | 组合化学工业株式会社 | 2022-01-04 | — | — | CN | disclosed |
| CN-111542514-B | Process for producing mercaptoformamidinate compound | 组合化学工业株式会社 | 2021-09-03 | — | — | CN | disclosed |
| CN-112004805-A | Process for producing 5, 5-disubstituted-4, 5-dihydroisoxazoles | 组合化学工业株式会社 | 2020-11-27 | — | — | CN | disclosed |
| CN-111542514-A | Process for producing mercaptoformamidinate compound | 组合化学工业株式会社 | 2020-08-14 | — | — | CN | disclosed |
| CN-111491926-A | Novel method for producing 5, 5-disubstituted-4, 5-dihydroisoxazoles | 组合化学工业株式会社 | 2020-08-04 | — | — | CN | disclosed |