⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2706 | 1.00 | — | — | |
| SCHEMBL2098378 | 0.72 | — | — | |
| Hydroxyl Radical SCHEMBL4970981 | 0.67 | — | — | |
| SCHEMBL5464960 | 0.64 | — | — | |
| SCHEMBL3504454 | 0.63 | — | — | |
| Butadiene SCHEMBL2933701 | 0.63 | — | — | |
| Butadiene SCHEMBL43684 | 0.63 | — | — | |
| SCHEMBL216116 | 0.63 | — | — | |
| Butadiene SCHEMBL28451 | 0.63 | — | — | |
| SCHEMBL216115 | 0.63 | — | — |
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 1374 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024118564-A1 | CHECKPOINT KINASE 1 (CHK1) INHIBITORS AND USES THEREOF | BOUNDLESS BIO, INC. (US) | 2024-06-06 | — | — | WO | claimed |
| EP-4359081-A1 | PYRAZOLYL DERIVATIVES AS INHIBITORS OF THE KRAS MUTANT PROTEIN | Novartis AG (CH) | 2024-05-01 | — | — | EP | claimed |
| EP-4355749-A1 | TRICYCLIC PARP1 INHIBITORS AND USES THEREOF | Xinthera, Inc. (US) | 2024-04-24 | — | — | EP | claimed |
| CN-117858854-A | Building material composition with high early and late strength | 巴斯夫欧洲公司 | 2024-04-09 | — | — | CN | claimed |
| WO-2024051852-A1 | PYRIMIDINE-CONTAINING POLYCYCLIC BIOLOGICAL INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2024-03-14 | — | — | WO | claimed |
| WO-2024011155-A1 | OXAZOLE TRPML1 AGONISTS AND USES THEREOF | LIBRA THERAPEUTICS, INC. (US) | 2024-01-11 | — | — | WO | claimed |
| WO-2024002223-A1 | HETEROCYCLIC DERIVATIVE AS INHIBITOR, METHOD FOR PREPARING SAME, AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2024-01-04 | — | — | WO | claimed |
| CN-114921391-B | 4, 5-cyclic 1,2, 4-triazolones | 拜耳股份有限公司 | 2024-01-02 | — | — | CN | claimed |
| CN-117279644-A | Substituted 3, 6-dihydro-2H-1, 3, 4-oxadiazin-2-ones for the treatment of sarcomas | 拜耳股份有限公司 | 2023-12-22 | — | — | CN | claimed |
| WO-2023230477-A1 | PYRIDINE CHECKPOINT KINASE 1 (CHK1) INHIBITORS AND USES THEREOF | BOUNDLESS BIO, INC. (US) | 2023-11-30 | — | — | WO | claimed |
| EP-0135894-A2 | N-carbamoylarylcarboximidic-acid esters, composition and pesticidal use | HOECHST AKTIENGESELLSCHAFT (DE) | 1985-04-03 | — | — | EP | claimed |
| EP-0034039-B1 | LIQUID DETERGENT COMPOSITION | THE PROCTER & GAMBLE COMPANY (US) | 1984-09-26 | — | — | EP | claimed |
| EP-0028038-B1 | ISOTROPIC LIQUID DETERGENT COMPOSITIONS CONTAINING MULTICOMPONENT ACTIVE SYSTEM | THE PROCTER & GAMBLE COMPANY (US) | 1984-07-25 | — | — | EP | claimed |
| US-4391808-A | NEUROLEPTIC AND ANTIPSYCHOTIC AGENTS | CIBA-GEIGY CORPORATION (US) | 1983-07-05 | — | — | US | claimed |
| US-4316824-A | NONIONIC SURFACTANTS | THE PROCTER & GAMBLE COMPANY (US) | 1982-02-23 | — | — | US | claimed |
| EP-0034039-A1 | Liquid detergent composition | THE PROCTER & GAMBLE COMPANY (US) | 1981-08-19 | — | — | EP | claimed |
| EP-0028038-A1 | Isotropic liquid detergent compositions containing multicomponent active system | THE PROCTER & GAMBLE COMPANY (US) | 1981-05-06 | — | — | EP | claimed |
| US-4247424-A | WATER IN OIL EMULSIONS INCLUDING A HYDROPHOBIC EMULSIFIER, NONIONIC SURFACTANT, AMINE OXIDE, AND A SOAP BUILDER; FOR USE IN COLD WATER | THE PROCTER & GAMBLE COMPANY (US) | 1981-01-27 | — | — | US | claimed |
| EP-0019475-A2 | Process for preparing adjacently disubstituted ketones, novel prostaglandins E1 and anti-thrombotic compositions containing them | TEIJIN LIMITED (JP) | 1980-11-26 | — | — | EP | claimed |
| US-3968066-A | Oil and water repellent textile composition containing a fluorochemical polyurethane resin and a quaternary ammonium salt | CIBA-GEIGY CORPORATION (US) | 1976-07-06 | — | — | US | claimed |