⚠ 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 | |
|---|---|---|---|---|
| Heptane SCHEMBL6260859 | 0.95 | — | — | |
| Dodecane SCHEMBL28209229 | 0.95 | TSHR (0.80) | — | |
| Hexane SCHEMBL1706108 | 0.89 | TSHR (0.70) | — | |
| Hexane SCHEMBL27926505 | 0.89 | TSHR (0.70) | — | |
| Hexane SCHEMBL183946 | 0.89 | — | — | |
| Hexane SCHEMBL9557662 | 0.88 | TSHR (0.88) | — | |
| Hexane SCHEMBL357364 | 0.88 | TSHR (0.88) | — | |
| Hexane SCHEMBL8705498 | 0.88 | TSHR (0.88) | — | |
| Hexane SCHEMBL9859565 | 0.88 | TSHR (0.88) | — | |
| Hexane SCHEMBL399 | 0.88 | — | — |
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 1063 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9199956-B2 | Process for chemical conversion of cellulose isolated from aromatic spent biomass to hydroxymethyl furfural | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2015-12-01 | — | — | US | claimed |
| US-20100041896-A1 | Macrolide compound with bis-oxazoly | FUJIAN INSTITUTE OF MICROBIOLOGY (CN) | 2010-02-18 | — | — | US | claimed |
| US-12037325-B2 | 1,2-diaminobenzimidazole derivative | CARNA BIOSCIENCES, INC. (JP) | 2024-07-16 | — | — | US | disclosed |
| US-20240226115-A1 | AXL INHIBITOR COMPOUNDS | ARCUS BIOSCIENCES, INC. | 2024-07-11 | — | — | US | disclosed |
| US-20240210412-A1 | SULFONYL-TRIAZOLE COMPOUNDS USEFUL AS LIGANDS AND INHIBITORS OF PROSTAGLANDIN REDUCTASE 2 | UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) | 2024-06-27 | — | — | US | disclosed |
| EP-4373811-A1 | NOVEL 1,2-DIAMINOBENZIMIDAZOLE DERIVATIVE | Carna Biosciences, Inc. (JP) | 2024-05-29 | — | — | EP | disclosed |
| EP-3703134-B1 | BIOSENSOR COMPRISING GRAPHENE TRANSISTOR FUNCTIONALIZED WITH N-HETEROCYCLIC CARBENE COMPOUND AND FABRICATION METHOD THEREFOR | KOREA RES INST BIOSCIENCE & BIOTECHNOLOGY (KR) | 2024-04-17 | — | — | EP | disclosed |
| EP-4349331-A1 | NOVEL AMP-ACTIVATED PROTEIN KINASE ACTIVATOR | Kyoto Pharmaceutical University (JP) | 2024-04-10 | — | — | EP | disclosed |
| EP-4341261-A1 | AXL COMPOUNDS | Arcus Biosciences, Inc. (US) | 2024-03-27 | — | — | EP | disclosed |
| EP-4341262-A1 | AXL INHIBITOR COMPOUNDS | Arcus Biosciences, Inc. (US) | 2024-03-27 | — | — | EP | disclosed |
| WO-2024050312-A2 | T-TYPE VOLTAGE-GATED CALCIUM CHANNEL POTENTIATORS | THE BROAD INSTITUTE, INC. (US) | 2024-03-07 | — | — | WO | disclosed |
| EP-0193132-A2 | Labdan-derivatives, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1986-09-03 | — | — | EP | disclosed |
| US-4608079-A | Imidazolidinones, and imidazolidinethiones, process and intermediates for the preparation thereof, and use of said compounds as herbicidal agents | AMERICAN CYANAMID COMPANY (US) | 1986-08-26 | — | — | US | disclosed |
| EP-0180399-A2 | Anti-tumor 4-Hydroxy-2-cyclopentenones | TEIJIN LIMITED (JP) | 1986-05-07 | — | — | EP | disclosed |
| US-4500518-A | ANALGESICS, HYPTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1985-02-19 | — | — | US | disclosed |
| EP-0061313-B1 | BIS-ESTERS OF 1,1-ALKANEDIOLS WITH 6-BETA-HYDROXYMETHYLPENICILLANIC ACID 1,1-DIOXIDE AND BETA-LACTAM ANTIBIOTICS | PFIZER INC. (US) | 1985-01-16 | — | — | EP | disclosed |
| US-4490555-A | 9-Substituted carbacyclin analogs | THE UPJOHN COMPANY (US) | 1984-12-25 | — | — | US | disclosed |
| EP-0104403-A1 | New method for the synthesis of 5-thio-1,2,3-thiadiazole | AMERICAN CYANAMID COMPANY (US) | 1984-04-04 | — | — | EP | disclosed |
| EP-0029341-A2 | Nitrogen-containing prostacyclin analogues, their preparation and compositions containing them | THE UPJOHN COMPANY (US) | 1981-05-27 | — | — | EP | disclosed |
| US-4232038-A | ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS, AND MUSCLE RELAXANTS | SYNTEX (U.S.A.) INC. (US) | 1980-11-04 | — | — | US | disclosed |