⚠ 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 | |
|---|---|---|---|---|
| Propane SCHEMBL27928586 | 0.95 | — | — | |
| Propane SCHEMBL27928583 | 0.95 | — | — | |
| Trimethylammonium SCHEMBL28881986 | 0.88 | ALDH1A1 (0.38) | — | |
| Butane SCHEMBL1874913 | 0.86 | — | — | |
| Butane SCHEMBL30927845 | 0.86 | ALDH1A1 (0.44) | — | |
| Alcohol SCHEMBL1052547 | 0.86 | — | — | |
| Propionaldehyde SCHEMBL19638265 | 0.82 | — | — | |
| Alcohol SCHEMBL17846988 | 0.82 | — | — | |
| Butane SCHEMBL14855915 | 0.82 | — | — | |
| Alcohol SCHEMBL27662209 | 0.82 | — | — |
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 70 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105209443-B | Indoleamine 2, 3-dioxygenase (IDO) inhibitors | 百时美施贵宝公司 | 2018-08-07 | — | — | CN | claimed |
| CN-108368107-A | FUSED HETEROCYCLIC COMPOUNDS AS S1P MODULATORS | 艾伯维公司 | 2018-08-03 | — | — | CN | claimed |
| CN-106811819-A | A kind of preparation method of anti-molten droplet fiber | 青岛大学 | 2017-06-09 | — | — | CN | claimed |
| CN-106164066-A | Cyclopropylamines as lsd1 inhibitors | 因赛特公司 | 2016-11-23 | — | — | CN | claimed |
| CN-103517896-B | (E)-3-(3-Acetyl-4-hydroxy-5-methoxy-phenyl)-N-(4-hydroxy-1-methyl-3-octyloxy-2-oxo-1,2-dihydro-quinolin-7-yl)-acrylamide | 葛兰素史密斯克莱有限责任公司 | 2016-09-21 | — | — | CN | claimed |
| EP-0495011-A4 | HYDROPHILIC POLYURETHANE ELASTOMERS | — | 1992-08-12 | — | — | EP | claimed |
| EP-0495011-A1 | HYDROPHILIC POLYURETHANE ELASTOMERS | PolyMedica Industries, Inc. (US) | 1992-07-22 | — | — | EP | claimed |
| WO-1991005809-A1 | HYDROPHILIC POLYURETHANE ELASTOMERS | POLYMEDICA INDUSTRIES, INC. (US) | 1991-05-02 | — | — | WO | claimed |
| WO-2023044171-A1 | INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF | Pardes Biosciences, Inc. (US) | 2023-03-23 | — | — | WO | disclosed |
| EP-3908585-A1 | IMIDAZO[1,2-B]PYRIDAZINE IL-17A INHIBITORS | ELI LILLY AND COMPANY (US) | 2021-11-17 | — | — | EP | disclosed |
| EP-3773576-A1 | CEREBLON BINDERS FOR THE DEGRADATION OF IKAROS | C4 Therapeutics, Inc. (US) | 2021-02-17 | — | — | EP | disclosed |
| WO-2020146194-A1 | IMIDAZO[1,2-B]PYRIDAZINE IL-17A INHIBITORS | ELI LILLY AND COMPANY (US) | 2020-07-16 | — | — | WO | disclosed |
| CN-110483272-A | The new method of chiral rhodium catalyst catalysis asymmetric syntheses (1S, 2S) -2- fluorine cyclopropane-carboxylic acid | CHEM STONE INC | 2019-11-22 | — | — | CN | disclosed |
| CN-110461159-A | Fungicidal compositions | SYNGENTA PARTICIPATIONS AG | 2019-11-15 | — | — | CN | disclosed |
| CN-1330640-C | Substituted bicyclic derivatives for the treatment of abnormal cell growth | PFIZER PROD INC (US) | 2007-08-08 | — | — | CN | disclosed |
| EP-1605896-A2 | 7-AMINO- ISOINDOLYL COMPOUNDS AMD THEIR PHARMACEUTICAL USES | CELGENE CORPORATION (US) | 2005-12-21 | — | — | EP | disclosed |
| CN-1576275-A | Substituted bicyclic derivatives for the treatment of abnormal cell growth | PFIZER PROD INC (US) | 2005-02-09 | — | — | CN | disclosed |
| WO-2004080423-A2 | 7-AMINO- ISOINDOLYL COMPOUNDS AMD THEIR PHARMACEUTICAL USES | CELGENE CORPORATION (US) | 2004-09-23 | — | — | WO | disclosed |
| CN-1437594-A | Substituted bicyclic derivatives for the treatment of abnormal cell growth | PFIZER PROD INC (US) | 2003-08-20 | — | — | CN | disclosed |
| CN-85106963-A | Insecticidal compounds | — | 1987-07-08 | — | — | CN | disclosed |