⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9137966 | 0.80 | — | — | |
| SCHEMBL867084 | 0.78 | — | — | |
| Methoxymethane SCHEMBL10627012 | 0.74 | CHRM2 (0.31) | — | |
| SCHEMBL5271092 | 0.73 | — | — | |
| SCHEMBL13006245 | 0.72 | — | — | |
| SCHEMBL5317426 | 0.69 | — | — | |
| SCHEMBL5169803 | 0.69 | — | — | |
| SCHEMBL317280 | 0.69 | — | — | |
| SCHEMBL11575542 | 0.69 | — | — | |
| SCHEMBL5258 | 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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3766882-B1 | PHTHALAZINE ISOXAZOLE ALKOXY DERIVATIVES, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF | SHANGHAI SIMR BIOTECHNOLOGY CO LTD (CN) | 2023-08-23 | — | — | EP | claimed |
| EP-2794009-B1 | BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER | KANCERA AB (SE) | 2017-08-30 | — | — | EP | claimed |
| EP-1090005-B1 | PYRAZOLO 1,5-a]TRIAZINE CORTICOTROPIN RELEASING FACTOR ANTAGONISTS | BRISTOL MYERS SQUIBB PHARMA CO (US) | 2003-08-20 | — | — | EP | claimed |
| EP-0594484-A1 | 2-Aminopyrimidin-4-carboxamide derivatives, their preparation and their use in therapy | SYNTHELABO (FR) | 1994-04-27 | — | — | EP | claimed |
| EP-0355544-B1 | Substituted decalin amines, method for their preparation and their use in pesticides | BAYER AG (DE) | 1994-01-26 | — | — | EP | claimed |
| EP-0355597-B1 | SUBSTITUTED DIOXOLANYLETHYLAMINES, PROCESS FOR THEIR PREPARATION, THEIR USE IN PESTICIDES, AND INTERMEDIATES | BAYER AG (DE) | 1993-06-09 | — | — | EP | claimed |
| EP-0289913-B1 | PARASITICIDAL AGENT BASED ON SUBSTITUTED AMINOMETHYL HETEROCYCLES | BAYER AG (DE) | 1993-01-13 | — | — | EP | claimed |
| EP-0359979-B1 | AMINOMETHYLHETEROCYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION, THEIR USE IN PESTICIDES, AND INTERMEDIATES | BAYER AG (DE) | 1992-12-30 | — | — | EP | claimed |
| EP-0281842-B1 | AMINOMETHYL-HETEROCYCLES | BAYER AG (DE) | 1991-07-17 | — | — | EP | claimed |
| EP-0278352-B1 | AMINOMETHYL-TETRAHYDRO-FURANES | BAYER AG (DE) | 1991-04-10 | — | — | EP | claimed |
| EP-0278311-B1 | 2-AMINOMETHYL TETRAHYDROFURANES | BAYER AG (DE) | 1990-07-18 | — | — | EP | claimed |
| US-10711075-B2 | Method of preparing rubber composition including syndiotactic 1,2-polybutadiene | KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) | 2020-07-14 | — | — | US | disclosed |
| US-20190023815-A1 | METHOD OF PREPARING RUBBER COMPOSITION INCLUDING SYNDIOTACTIC 1,2-POLYBUTADIENE | KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) | 2019-01-24 | — | — | US | disclosed |
| EP-0594484-A1 | 2-Aminopyrimidin-4-carboxamide derivatives, their preparation and their use in therapy | SYNTHELABO (FR) | 1994-04-27 | — | — | EP | disclosed |