Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NR1D1 | P20393 | 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 | |
|---|---|---|---|---|
| SCHEMBL3530965 | 0.87 | ALDH1A1 (0.51) | ALDH1A1POLBMAPTLMNAMAPK1 | |
| SCHEMBL429356 | 0.85 | ALDH1A1 (0.65) | ALDH1A1POLBMAPTMAPK1CYP2C19 | |
| SCHEMBL1646651 | 0.82 | TDP1 (0.52) | ALDH1A1POLBLMNAMAPK1HSD11B1 | |
| SCHEMBL6680006 | 0.81 | PTPRC (0.54) | ALDH1A1POLBMAPTLMNACES1 | |
| SCHEMBL395369 | 0.81 | ALDH1A1 (0.56) | ALDH1A1POLBMAPTLMNAGAA | |
| SCHEMBL27030901 | 0.79 | MAPT (0.69) | ALDH1A1MAPTLMNA | |
| SCHEMBL1647740 | 0.79 | MAPK1 (0.55) | ALDH1A1POLBMAPTMAPK1HSD11B1 | |
| SCHEMBL6218720 | 0.78 | ALDH1A1 (0.57) | ALDH1A1POLBMAPTCYP2C19GAA | |
| SCHEMBL15987513 | 0.78 | CYP2C19 (0.65) | ALDH1A1MAPTLMNACYP2C19GAA | |
| SCHEMBL2814601 | 0.77 | MAPT (0.55) | ALDH1A1POLBMAPTLMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4619406-A1 | TRICYCLIC COMPOUNDS | Schrödinger, Inc. (US) | 2025-09-24 | — | — | EP | disclosed |
| WO-2024107393-A1 | TRICYCLIC COMPOUNDS | SCHRÖDINGER, INC. (US) | 2024-05-23 | — | — | WO | disclosed |
| CN-110818641-B | Pyridazine-3-formamide compound, preparation method and application thereof in medicine and pharmacology | 北京诺诚健华医药科技有限公司 | 2022-10-14 | — | — | CN | disclosed |
| CN-110818641-A | Pyridazine-3-formamide compound, preparation method and application thereof in medicine and pharmacology | 北京诺诚健华医药科技有限公司 | 2020-02-21 | — | — | CN | disclosed |