Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29883804 | 1.00 | KDM4E (0.40) | KDM4EALDH1A1HPGDGAAMAPT | |
| SCHEMBL12678598 | 0.83 | KDM4E (0.38) | KDM4EALDH1A1HPGDGAAMAPT | |
| SCHEMBL29882882 | 0.78 | ALDH1A1 (0.61) | KDM4EALDH1A1MAPTLMNAHTT | |
| SCHEMBL28428419 | 0.78 | ALDH1A1 (0.61) | KDM4EALDH1A1MAPTLMNAHTT | |
| SCHEMBL13358909 | 0.78 | PIK3CG (0.36) | KDM4EALDH1A1HPGDGAAMAPT | |
| SCHEMBL30753556 | 0.77 | HCAR3 (0.48) | KDM4EALDH1A1MAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL2766191 | 0.77 | HCAR3 (0.48) | KDM4EALDH1A1MAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL25355967 | 0.77 | ABL1 (0.39) | KDM4EALDH1A1HPGDGAAMAPT | |
| SCHEMBL30623323 | 0.77 | ABL1 (0.39) | KDM4EALDH1A1HPGDGAAMAPT | |
| SCHEMBL12508238 | 0.76 | KDM4E (0.58) | KDM4EALDH1A1HPGDGAAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111349043-B | Intermediate for preparing pimenib and preparation method and application thereof | 上海医药工业研究院 | 2022-09-27 | — | — | CN | disclosed |
| CN-111349043-A | Intermediate for preparing pimenib and preparation method and application thereof | 上海医药工业研究院 | 2020-06-30 | — | — | CN | disclosed |