Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 14/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.34 |
| ▸ | GAA | P10253 | 6/20 | 0.34 |
| ▸ | HPGD | P15428 | 6/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.34 |
| ▸ | GLA | P06280 | 3/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | CASP7 | P55210 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL24575433 | 1.00 | ALDH1A1 (0.36) | ALDH1A1MAPK1MEN1KMT2AESR1 | |
| SCHEMBL30209293 | 0.90 | FEN1 (0.37) | ALDH1A1MAPK1MEN1KMT2AMAPT | |
| SCHEMBL26611555 | 0.89 | PIK3R1 (0.34) | ALDH1A1KDM4EGAAHPGDHSD17B10 | |
| SCHEMBL26611552 | 0.89 | PIK3R1 (0.34) | ALDH1A1KDM4EGAAHPGDHSD17B10 | |
| SCHEMBL24186664 | 0.83 | ALDH1A1 (0.34) | ALDH1A1MAPK1MEN1KMT2AESR1 | |
| SCHEMBL24574883 | 0.83 | ALDH1A1 (0.34) | ALDH1A1MAPK1MEN1KMT2AESR1 | |
| SCHEMBL29924776 | 0.83 | CNR2 (0.34) | ALDH1A1MAPK1MEN1KMT2AESR1 | |
| SCHEMBL31025680 | 0.77 | ALDH1A1 (0.37) | ALDH1A1MAPK1MEN1KMT2ARAB9A | |
| SCHEMBL20279928 | 0.77 | ALDH1A1 (0.44) | ALDH1A1MAPK1MEN1KMT2AESR1 | |
| SCHEMBL20288032 | 0.77 | ALDH1A1 (0.44) | ALDH1A1MAPK1MEN1KMT2AESR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4269399-A1 | FIVE-MEMBERED RING DERIVATIVE AND MEDICAL USE THEREOF | Sichuan Haisco Pharmaceutical Co., Ltd. (CN) | 2023-11-01 | — | — | EP | disclosed |
| WO-2022135572-A1 | FIVE-MEMBERED RING DERIVATIVE AND MEDICAL USE THEREOF | 四川海思科制药有限公司 | 2022-06-30 | — | — | WO | disclosed |