⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL10788206 | 1.00 | — | — | |
| Fluoride SCHEMBL337023 | 1.00 | ABCB11 (0.30) | — | |
| SCHEMBL384317 | 0.95 | — | — | |
| Ethane SCHEMBL2526199 | 0.91 | — | — | |
| Propane SCHEMBL2521863 | 0.91 | — | — | |
| SCHEMBL28950638 | 0.91 | — | — | |
| Ethane SCHEMBL4578616 | 0.87 | — | — | |
| Butane SCHEMBL2524930 | 0.87 | — | — | |
| Fluoride SCHEMBL28981522 | 0.86 | — | — | |
| Dimethyl Sulfoxide SCHEMBL5667863 | 0.83 | — | — |
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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020243153-A1 | FUSED HETEROCYCLIC DERIVATIVES | Janssen Sciences Ireland Unlimited Company (IE) | 2020-12-03 | — | — | WO | claimed |
| CN-111278809-B | Bicyclic sulfones and sulfoxides, and methods of use thereof | 豪夫迈·罗氏有限公司 | 2024-06-25 | — | — | CN | disclosed |
| EP-4236963-A1 | 5ALPHA-HYDROXY-6BETA-[2-(1-H-IMIDAZOL-4-YL)-ETHYLAMINO]-CHOLESTAN-3BETA-OL ANALOGUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME FOR USE IN THE TREATMENT OF CANCER | Dendrogenix (BE) | 2023-09-06 | — | — | EP | disclosed |
| CN-115702024-A | Difluorocyclohexyl derivatives as IL-17 modulators | UCB生物制药有限责任公司 | 2023-02-14 | — | — | CN | disclosed |
| CN-109641854-B | Modulators of integrated stress pathways | 卡里科生命科学有限责任公司 | 2023-02-03 | — | — | CN | disclosed |
| CN-115066418-A | Carboxy derivatives with anti-inflammatory properties | 西特瑞治疗有限公司 | 2022-09-16 | — | — | CN | disclosed |
| CN-115003296-A | Compounds and methods for treating cystic fibrosis | 弗拉特利发现实验室有限责任公司 | 2022-09-02 | — | — | CN | disclosed |
| CN-114555585-A | HPK1 inhibitors and uses thereof | 上海齐鲁锐格医药研发有限公司 | 2022-05-27 | — | — | CN | disclosed |
| WO-2022090427-A1 | 5ALPHA-HYDROXY-6BETA-[2-(1-H-IMIDAZOL-4-YL)-ETHYLAMINO]-CHOLESTAN-3BETA-OL ANALOGUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME FOR USE IN THE TREATMENT OF CANCER | DENDROGENIX (BE) | 2022-05-05 | — | — | WO | disclosed |
| WO-2020243153-A1 | FUSED HETEROCYCLIC DERIVATIVES | Janssen Sciences Ireland Unlimited Company (IE) | 2020-12-03 | — | — | WO | disclosed |
| US-5750553-A | ANTIANDROGENIC AGENTS | ROUSSEL UCLAF (FR) | 1998-05-12 | — | — | US | disclosed |
| US-5434175-A | PARASITICIDES, INSECTICIDES AND MITICIDES | ROUSSEL UCLAF (FR) | 1995-07-18 | — | — | US | disclosed |
| US-5428043-A | Tricyclic-cyclic amines as novel cholinesterase inhibitors | PFIZER INC. (US) | 1995-06-27 | — | — | US | disclosed |
| US-5395845-A | Insecticides | ROUSSEL-UCLAF (FR) | 1995-03-07 | — | — | US | disclosed |
| US-5340835-A | Insecticides | ROUSSEL-UCLAF (FR) | 1994-08-23 | — | — | US | disclosed |
| US-5310746-A | Insecticides, miticides, nematocides | ROUSSEL UCLAF (FR) | 1994-05-10 | — | — | US | disclosed |
| US-5086047-A | Controlling estrogen production; breast cancer | ROUSSEL UCLAF, DEPARTMENT DES BREVETS (FR) | 1992-02-04 | — | — | US | disclosed |
| CN-1054600-A | New anticholinesterase three ring-cyclammonium | PFIZER (US) | 1991-09-18 | — | — | CN | disclosed |
| EP-0441517-A2 | Tricyclic amines as novel cholinesterase inhibitors | PFIZER INC. (US) | 1991-08-14 | — | — | EP | disclosed |
| US-4988684-A | Steroids for the inhibition of aromatase for the treatment of cancer | ROUSSEL UCLAF (FR) | 1991-01-29 | — | — | US | disclosed |