⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL22234676 | 0.84 | — | — | |
| SCHEMBL23366976 | 0.72 | — | — | |
| SCHEMBL22472300 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL23354162 | 0.70 | — | — | |
| SCHEMBL19900306 | 0.70 | LDHA (0.40) | — | |
| SCHEMBL2013537 | 0.69 | — | — | |
| SCHEMBL22234952 | 0.69 | TSHR (0.30) | — | |
| SCHEMBL231971 | 0.67 | — | — | |
| SCHEMBL23009419 | 0.67 | — | — | |
| SCHEMBL18367054 | 0.67 | — | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20250163078-A1 | IMIDAZOPYRIDAZINE DERIVATIVE, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF | Shanghai Simr Biotechnology Co., Ltd. (CN) | 2025-05-22 | — | — | US | disclosed |
| EP-4484433-A1 | IMIDAZOPYRIDAZINE DERIVATIVE, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF | Shanghai Simr Biotechnology Co., Ltd. (CN) | 2025-01-01 | — | — | EP | disclosed |
| WO-2024217500-A1 | ISOQUINOLINE COMPOUND, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF | 上海赛默罗生物科技有限公司 | 2024-10-24 | — | — | WO | disclosed |
| CN-118359538-A | Isoquinoline compound, preparation method, pharmaceutical composition and application thereof | 上海赛默罗生物科技有限公司 | 2024-07-19 | — | — | CN | disclosed |
| CN-116693555-A | Imidazopyridazine derivative, preparation method, pharmaceutical composition and application thereof | 上海赛默罗生物科技有限公司 | 2023-09-05 | — | — | CN | disclosed |
| WO-2023160475-A1 | IMIDAZOPYRIDAZINE DERIVATIVE, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF | 上海赛默罗生物科技有限公司 | 2023-08-31 | — | — | WO | disclosed |
| CN-112088160-B | 1-imidazothiadiazolo-2H-pyrrol-5-one derivatives | UCB生物制药有限责任公司 | 2023-07-04 | — | — | CN | disclosed |
| EP-3790885-B1 | 1-IMIDAZOTHIADIAZOLO-2H-PYRROL-5-ONE DERIVATIVES | UCB Biopharma SRL (BE) | 2023-04-19 | — | — | EP | disclosed |
| US-11286266-B2 | 1-imidazothiadiazolo-2H-pyrrol-5-one derivatives | UCB Biopharma SRL | 2022-03-29 | — | — | US | disclosed |
| WO-2021198981-A1 | ANTIVIRAL COMPOUNDS AND USES THEREOF | Janssen Biopharma, Inc. (US) | 2021-10-07 | — | — | WO | disclosed |
| US-20210107922-A1 | 1-IMIDAZOTHIADIAZOLO-2H-PYRROL-5-ONE DERIVATIVES | UCB BIOPHARMA SRL (SOCIETE A RESPONSABILITE LIMITEE) (BE) | 2021-04-15 | — | — | US | disclosed |
| EP-3790885-A1 | 1-IMIDAZOTHIADIAZOLO-2H-PYRROL-5-ONE DERIVATIVES | UCB Biopharma SRL (BE) | 2021-03-17 | — | — | EP | disclosed |
| WO-2019215062-A1 | 1-IMIDAZOTHIADIAZOLO-2H-PYRROL-5-ONE DERIVATIVES | UCB BIOPHARMA SPRL (BE) | 2019-11-14 | — | — | WO | disclosed |
| WO-1996036635-A1 | OXIRANYL-TRIAZOLES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-11-21 | — | — | WO | disclosed |
| WO-1996036634-A1 | OXIRANYL-HYDROXYETHYL TRIAZOLES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-11-21 | — | — | WO | disclosed |
| EP-0560109-B1 | Process for the preparation of 1-fluorocyclopropyl-methyl-ketone | BAYER AG (DE) | 1996-07-17 | — | — | EP | disclosed |
| EP-0710642-A2 | Halogenoketones | BAYER AG (DE) | 1996-05-08 | — | — | EP | disclosed |
| US-5371295-A | Process for preparing 1-fluorocyclopropyl methyl ketone | BAYER AKTIENGESELLSCHAFT (DE) | 1994-12-06 | — | — | US | disclosed |
| US-5336809-A | Process for preparing 1-fluorocyclopropyl methyl ketone | BAYER AKTIENGESELLSCHAFT (DE) | 1994-08-09 | — | — | US | disclosed |
| EP-0560109-A2 | Process for the preparation of 1-fluorocyclopropyl-methyl-ketone | BAYER AG (DE) | 1993-09-15 | — | — | EP | disclosed |