⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL193257 | 1.00 | — | — | |
| SCHEMBL13295810 | 1.00 | — | — | |
| SCHEMBL20819984 | 0.89 | — | — | |
| SCHEMBL11917534 | 0.85 | — | — | |
| Cyclohexene SCHEMBL10946559 | 0.83 | — | — | |
| SCHEMBL13636956 | 0.81 | — | — | |
| SCHEMBL19302097 | 0.81 | — | — | |
| SCHEMBL762700 | 0.81 | — | — | |
| SCHEMBL10150513 | 0.79 | — | — | |
| SCHEMBL11228506 | 0.79 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240229091-A1 | KETOREDUCTASE POLYPEPTIDES FOR THE PRODUCTION OF (R)-3-HYDROXYTHIOLANE | CODEXIS INC (US) | 2024-07-11 | — | — | US | disclosed |
| WO-2020135771-A1 | HETEROCYCLIC COMPOUND INTERMEDIATE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 武汉朗来科技发展有限公司 | 2020-07-02 | — | — | WO | disclosed |
| US-20180187223-A1 | KETOREDUCTASE POLYPEPTIDES FOR THE PRODUCTION OF (R)-3-HYDROXYTHIOLANE | INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT | 2018-07-05 | — | — | US | disclosed |
| US-20180179185-A1 | AMINO COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS | ACHILLION PHARMACEUTICALS, INC. (US) | 2018-06-28 | — | — | US | disclosed |
| US-9932615-B2 | Ketoreductase polypeptides for the production of (R)-3-hydroxythiolane | CODEXIS, INC. (US) | 2018-04-03 | — | — | US | disclosed |
| US-20170320860-A1 | HETEROCYCLIC TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR | AMGEN INC. | 2017-11-09 | — | — | US | disclosed |
| US-20160289717-A1 | KETOREDUCTASE POLYPEPTIDES FOR THE PRODUCTION OF (R)-3-HYDROXYTHIOLANE | INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT | 2016-10-06 | — | — | US | disclosed |
| US-9394552-B2 | Ketoreductase polypeptides for the production of (R)-3-hydroxythiolane | CODEXIS, INC. (US) | 2016-07-19 | — | — | US | disclosed |
| US-20150125910-A1 | KETOREDUCTASE POLYPEPTIDES FOR THE PRODUCTION OF (R)-3-HYDROXYTHIOLANE | INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT | 2015-05-07 | — | — | US | disclosed |
| US-8962285-B2 | Ketoreductase polypeptides for the production of (R)-3-hydroxythiolane | CODEXIS, INC. (US) | 2015-02-24 | — | — | US | disclosed |
| US-8513162-B2 | Halogen-containing organosulfur compound and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-08-20 | — | — | US | disclosed |
| EP-2586596-A1 | THREE-DIMENSIONAL POLYMER-METAL COMPOSITE MICROSTRUCTURE AND METHOD FOR PRODUCING SAME | Japan Science and Technology Agency (JP) | 2013-05-01 | — | — | EP | disclosed |
| EP-2520568-A1 | Spirocyclic nitriles as inhibitors of protease | SANOFI (FR) | 2012-11-07 | — | — | EP | disclosed |
| US-20120276599-A1 | KETOREDUCTASE POLYPEPTIDES FOR THE PRODUCTION OF (R)-3-HYDROXYTHIOLANE | PFIZER, INC. (US) | 2012-11-01 | — | — | US | disclosed |
| US-8227229-B2 | Ketoreductase polypeptides for the production of (R)-3-hydroxythiolane | CODEXIS, INC. (US) | 2012-07-24 | — | — | US | disclosed |
| US-20110217754-A1 | KETOREDUCTASE POLYPEPTIDES FOR THE PRODUCTION OF (R)-3-HYDROXYTHIOLANE | CODEXIS, INC. (US) | 2011-09-08 | — | — | US | disclosed |
| WO-2010074327-A1 | HALOGEN-CONTAINING ORGANOSULFUR COMPOUNDS AND USE THEREOF FOR CONTROLLING ARTHROPOD PEST | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-07-01 | — | — | WO | disclosed |
| US-20100081693-A1 | THIADIAZOLE COMPOUND AND USE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-04-01 | — | — | US | disclosed |
| WO-2007137738-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI-AVENTIS (DE) | 2007-12-06 | — | — | WO | disclosed |