⚠ 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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL295 | 0.96 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL39465 | 0.96 | ALDH1A1 (0.50) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL3950101 | 0.96 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL3507077 | 0.96 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL23094034 | 0.92 | ALDH1A1 (0.47) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL25287607 | 0.92 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL6599585 | 0.92 | ALDH1A1 (0.47) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL25293989 | 0.92 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL147403 | 0.92 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL25292879 | 0.92 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113571690-B | Modified single crystal ternary cathode material and preparation method thereof | 合肥国轩高科动力能源有限公司 | 2022-07-08 | — | — | CN | claimed |
| CN-113571690-A | Modified single crystal ternary positive electrode material and preparation method thereof | 合肥国轩高科动力能源有限公司 | 2021-10-29 | — | — | CN | claimed |
| EP-0658552-B1 | Process for the preparation of alpha-tocopherol derivatives | EISAI CO LTD (JP) | 1999-03-31 | — | — | EP | claimed |
| US-5532387-A | CYCLIZATION OF TRIMETHYLHYDROQUINONE AND AN ALKENYL ALCOHOL, REUSABLE CATALYST, IIIB FLUOROSULFONATE, NITRATE, SULFATE, OR FLUOROALKYLSULFONATE | EISAI CO., LTD. (JP) | 1996-07-02 | — | — | US | claimed |
| CN-1108254-A | Process for the preparation of alpha-tocopherol derivatives | EISAI CO LTD (JP) | 1995-09-13 | — | — | CN | claimed |
| EP-0658552-A1 | Process for the preparation of alpha-tocopherol derivatives | Eisai Co., Ltd. (JP) | 1995-06-21 | — | — | EP | claimed |
| CN-113571690-B | Modified single crystal ternary cathode material and preparation method thereof | 合肥国轩高科动力能源有限公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-113571690-A | Modified single crystal ternary positive electrode material and preparation method thereof | 合肥国轩高科动力能源有限公司 | 2021-10-29 | — | — | CN | disclosed |
| CN-100379788-C | Use of catalyst for preparing polylol aliphatic oligocarbonate | BAYER AG (DE) | 2008-04-09 | — | — | CN | disclosed |
| US-6894182-B2 | Aliphatic oligocarbonate polyols prepared in the presence of a catalyst and a process for preparing the same | BAYER AKTIENGESELLSCHAFT (DE) | 2005-05-17 | — | — | US | disclosed |
| US-20030125576-A1 | Aliphatic oligocarbonate polyols prepared in the presence of a catalyst and a process for preparing the same | COVESTRO DEUTSCHLAND AG (DE) | 2003-07-03 | — | — | US | disclosed |
| CN-1420134-A | Use of catalyst for preparing polylol aliphatic oligocarbonate | BAYER AG (DE) | 2003-05-28 | — | — | CN | disclosed |
| CN-1052978-C | Process for the preparation of alpha-tocopherol derivatives | EISAI CO LTD (JP) | 2000-05-31 | — | — | CN | disclosed |
| EP-0658552-B1 | Process for the preparation of alpha-tocopherol derivatives | EISAI CO LTD (JP) | 1999-03-31 | — | — | EP | disclosed |
| US-5532387-A | CYCLIZATION OF TRIMETHYLHYDROQUINONE AND AN ALKENYL ALCOHOL, REUSABLE CATALYST, IIIB FLUOROSULFONATE, NITRATE, SULFATE, OR FLUOROALKYLSULFONATE | EISAI CO., LTD. (JP) | 1996-07-02 | — | — | US | disclosed |
| CN-1108254-A | Process for the preparation of alpha-tocopherol derivatives | EISAI CO LTD (JP) | 1995-09-13 | — | — | CN | disclosed |
| EP-0658552-A1 | Process for the preparation of alpha-tocopherol derivatives | Eisai Co., Ltd. (JP) | 1995-06-21 | — | — | EP | disclosed |