⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1652019 | 0.83 | TAAR1 (0.31) | — | |
| SCHEMBL458035 | 0.82 | — | — | |
| SCHEMBL3334611 | 0.81 | TAAR1 (0.30) | — | |
| SCHEMBL27854866 | 0.79 | TYR (0.35) | — | |
| SCHEMBL28130205 | 0.79 | — | — | |
| SCHEMBL58401 | 0.78 | GABRA1 (0.33) | — | |
| SCHEMBL17894914 | 0.77 | — | — | |
| SCHEMBL27343129 | 0.77 | — | — | |
| SCHEMBL29130959 | 0.77 | MEN1 (0.35) | — | |
| SCHEMBL458360 | 0.76 | — | — |
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 58 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5010099-A | Immunomodulation; antitumor agents | HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) | 1991-04-23 | — | — | US | claimed |
| US-4939168-A | Discodermolide compounds, compositions containing same and methods of preparation and use | HARBOR BRANCH OCEANOGRAPHICS INSTITUTION, INC. (US) | 1990-07-03 | — | — | US | claimed |
| CN-110475785-B | Peptide compound, method for producing same, composition for screening, and method for selecting peptide compound | 富士胶片株式会社 | 2023-06-13 | — | — | CN | disclosed |
| CN-109906224-B | Triazolopyridine compounds and uses thereof | 诺华股份有限公司 | 2022-02-25 | — | — | CN | disclosed |
| EP-2900645-B1 | HERBICIDAL AND FUNGICIDAL 3-PHENYLISOXAZOLIN DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2019-08-21 | — | — | EP | disclosed |
| CN-110087687-A | Compound, composition and application thereof | 赛诺维信制药公司 | 2019-08-02 | — | — | CN | disclosed |
| CN-109906224-A | TRIAZOLOPYRIDINE COMPOUNDS AND USES THEREOF | 诺华股份有限公司 | 2019-06-18 | — | — | CN | disclosed |
| EP-3045450-B1 | INTERMEDIATE COMPOUNDS IN PROCESSES FOR PRODUCING PYRIDAZINONE COMPOUNDS | SUMITOMO CHEMICAL CO (JP) | 2018-02-07 | — | — | EP | disclosed |
| CN-107406426-A | Cyclic ureas as ROCK inhibitors | 百时美施贵宝公司 | 2017-11-28 | — | — | CN | disclosed |
| US-9585392-B2 | 3-phenylisoxazolin derivatives with herbicidal action | BAYER CROPSCIENCE AG (DE) | 2017-03-07 | — | — | US | disclosed |
| CN-104277004-B | Prepare method and its intermediate of pyridazinone compound | 住友化学株式会社 | 2016-08-24 | — | — | CN | disclosed |
| US-5298657-A | From a cyanamide and an amine, Lewis acid catalyst | CAMBRIDGE NEUROSCIENCE INC. (US) | 1994-03-29 | — | — | US | disclosed |
| WO-1993019042-A1 | PREPARATION OF SUBSTITUTED GUANIDINES | CAMBRIDGE NEUROSCIENCE, INC. (US) | 1993-09-30 | — | — | WO | disclosed |
| EP-0486565-A1 | DISCODERMOLIDE COMPOUNDS, COMPOSITIONS CONTAINING SAME AND METHODS OF PREPARATION AND USE. | HARBOR BRANCH OCEANOGRAPHIC (US) | 1992-05-27 | — | — | EP | disclosed |
| US-5010099-A | Immunomodulation; antitumor agents | HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) | 1991-04-23 | — | — | US | disclosed |
| WO-1991001982-A1 | DISCODERMOLIDE COMPOUNDS, COMPOSITIONS CONTAINING SAME AND METHODS OF PREPARATION AND USE | HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) | 1991-02-21 | — | — | WO | disclosed |
| US-4939168-A | Discodermolide compounds, compositions containing same and methods of preparation and use | HARBOR BRANCH OCEANOGRAPHICS INSTITUTION, INC. (US) | 1990-07-03 | — | — | US | disclosed |
| US-4910331-A | Decyclizing, sulfonating a dithiolane ring with a sulfone compound | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-03-20 | — | — | US | disclosed |
| EP-0140352-B1 | NOVEL PROCESS FOR PRODUCING THIOLSULFONIC ACID DERIVATIVES | Takeda Chemical Industries, Ltd. (JP) | 1986-10-01 | — | — | EP | disclosed |
| EP-0140352-A2 | Novel process for producing thiolsulfonic acid derivatives | Takeda Chemical Industries, Ltd. (JP) | 1985-05-08 | — | — | EP | disclosed |