Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.45 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 2/20 | 0.40 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5265352 | 1.00 | ALDH1A1 (0.54) | ALDH1A1TSHRNPC1RAB9APKM | |
| SCHEMBL11869494 | 0.89 | ALDH1A1 (0.52) | ALDH1A1TSHRNPC1RAB9APKM | |
| SCHEMBL29918523 | 0.89 | ALDH1A1 (0.52) | ALDH1A1TSHRNPC1RAB9APKM | |
| SCHEMBL6773381 | 0.84 | ALDH1A1 (0.54) | ALDH1A1TSHRNPC1RAB9ATNKS2 | |
| SCHEMBL3360913 | 0.84 | CYP2A6 (0.46) | ALDH1A1TSHRNPC1RAB9APKM | |
| SCHEMBL13350235 | 0.83 | ERN1 (0.52) | ALDH1A1TSHRNPC1RAB9APKM | |
| SCHEMBL31227833 | 0.82 | TNKS2 (0.47) | ALDH1A1TSHRNPC1RAB9APKM | |
| SCHEMBL4889825 | 0.82 | ERN1 (0.50) | ALDH1A1TSHRMEN1KMT2AERN1 | |
| SCHEMBL13825831 | 0.82 | ESR2 (0.57) | ALDH1A1TSHRNPC1RAB9APKM | |
| SCHEMBL12084945 | 0.81 | MEN1 (0.52) | ALDH1A1NPC1RAB9APTPN1PTPN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116473965-B | Pyrazole MAGL inhibitors | H.隆德贝克有限公司 | 2025-03-18 | — | — | CN | disclosed |
| CN-116473965-A | Pyrazole MAGL inhibitors | H.隆德贝克有限公司 | 2023-07-25 | — | — | CN | disclosed |
| CN-110678456-B | Pyrazole MAGL inhibitors | H.隆德贝克有限公司 | 2023-05-02 | — | — | CN | disclosed |
| CN-111032034-B | Spiro compounds and methods of making and using the same | H.隆德贝克有限公司 | 2023-05-02 | — | — | CN | disclosed |