⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1547627 | 0.97 | — | — | |
| SCHEMBL11221727 | 0.97 | NOS3 (0.38) | — | |
| SCHEMBL2784950 | 0.92 | — | — | |
| SCHEMBL2787642 | 0.92 | — | — | |
| SCHEMBL398149 | 0.92 | — | — | |
| SCHEMBL1219807 | 0.80 | — | — | |
| SCHEMBL4857180 | 0.78 | NOS1 (0.48) | — | |
| SCHEMBL2423591 | 0.77 | — | — | |
| SCHEMBL295542 | 0.77 | NOS1 (0.50) | — | |
| SCHEMBL3283692 | 0.75 | NOS3 (0.33) | — |
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 852 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118240116-A | Method and device for preparing propylene polymer by gas-phase continuous polymerization | 中国神华煤制油化工有限公司 | 2024-06-25 | — | — | CN | claimed |
| CN-118234730-A | Heterocyclic NLRP3 inhibitors | 豪夫迈·罗氏有限公司 | 2024-06-21 | — | — | CN | claimed |
| US-20240199679-A1 | ADENOSINE DERIVATIVE HAVING ANTAGONISTIC ACTION ON A2A AND A3 ADENOSINE RECEPTORS AND METHOD FOR PREPARING SAME | FUTURE MEDICINE CO., LTD. (KR) | 2024-06-20 | — | — | US | claimed |
| WO-2024099993-A1 | TRIAZINONE DERIVATIVES AS NLRP3 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2024-05-16 | — | — | WO | claimed |
| US-20240132471-A1 | NOVEL COMPOUNDS | HOFFMANN-LA ROCHE INC. (US) | 2024-04-25 | — | — | US | claimed |
| EP-4347571-A1 | TRIAZINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER | F. Hoffmann-La Roche AG (CH) | 2024-04-10 | — | — | EP | claimed |
| US-20240059692-A1 | NEW INDAZOLE DERIVATIVES | HOFFMANN-LA ROCHE INC. (US) | 2024-02-22 | — | — | US | claimed |
| US-20240051975-A1 | NOVEL NAMPT ENZYME AGONIST AND PREPARATION AND USE THEREOF | TSINGHUA UNIVERSITY (CN) | 2024-02-15 | — | — | US | claimed |
| CN-117460718-A | Triazine derivatives and their use in the treatment of cancer | 豪夫迈·罗氏有限公司 | 2024-01-26 | — | — | CN | claimed |
| EP-4296273-A1 | ADENOSINE DERIVATIVE HAVING ANTAGONISTIC ACTION ON A2A AND A3 ADENOSINE RECEPTORS AND METHOD FOR PREPARING SAME | Future Medicine Co., Ltd. (KR) | 2023-12-27 | — | — | EP | claimed |
| US-4401670-A | Method for treating gonorrhea infections with 2-acetyl- and 2-propionylpyridine thiosemicarbazones | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1983-08-30 | — | — | US | claimed |
| EP-0044989-B1 | 5-SUBSITUTED 5,10-DIHYDRO-11H-DIBENZO(B,E)(1,4)DIAZEPIN-11-ONES, PROCESS FOR PREPARING THEM AND MEDICAMENTS CONTAINING THEM | Dr. Karl Thomae GmbH (DE) | 1983-05-25 | — | — | EP | claimed |
| US-4385055-A | 2-Acetyl-and 2-propionylpyridine thiosemicarbazones as antimalarials | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1983-05-24 | — | — | US | claimed |
| EP-0055444-A2 | Trisubstituted pyrimido(5,4-d)pyrimidines, their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1982-07-07 | — | — | EP | claimed |
| US-4317776-A | BACTERICIDES, ANTIMALARIAL, TREATMENT OF GONORRHEA | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1982-03-02 | — | — | US | claimed |
| EP-0044989-A1 | 5-Subsituted 5,10-dihydro-11H-dibenzo(b,e)(1,4)diazepin-11-ones, process for preparing them and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1982-02-03 | — | — | EP | claimed |
| US-4298612-A | CYCLOHEXANE-, CYCLOHEXENE-, OR NORBORNENE-ALKYLCARBONYLPIPERIDINES | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1981-11-03 | — | — | US | claimed |
| US-4291041-A | Alicyclic piperidine derivatives as insect repellents | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1981-09-22 | — | — | US | claimed |
| US-4010265-A | DIURETICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) | 1977-03-01 | — | — | US | claimed |
| US-4005201-A | DIURETICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) | 1977-01-25 | — | — | US | claimed |