⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13179149 | 1.00 | NPC1 (0.36) | — | |
| Ethylene Glycol SCHEMBL27888517 | 0.89 | TSHR (0.37) | — | |
| SCHEMBL12787632 | 0.89 | NPC1 (0.31) | — | |
| SCHEMBL2668613 | 0.89 | NPC1 (0.31) | — | |
| SCHEMBL191816 | 0.88 | — | — | |
| SCHEMBL5210320 | 0.88 | — | — | |
| SCHEMBL24739576 | 0.87 | SHBG (0.38) | — | |
| SCHEMBL8371431 | 0.87 | NPC1 (0.30) | — | |
| SCHEMBL600824 | 0.87 | GNAI3 (0.31) | — | |
| SCHEMBL17592150 | 0.87 | GNAI3 (0.31) | — |
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 107 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112469768-B | Polymerization condition setting method and method for producing optical material | 三井化学株式会社 | 2023-04-28 | — | — | CN | disclosed |
| US-20180155502-A1 | ORGANOSILICON COMPOUNDS HAVING AMINO ACID MOIETIES, AND PROCESS FOR PREPARATION THEREOF | WACKER CHEMIE AG (DE) | 2018-06-07 | — | — | US | disclosed |
| US-20180118773-A1 | CRYSTALLINE FORM OF BENZYLBENZENE SGLT2 INHIBITOR | THERACOSBIO, LLC | 2018-05-03 | — | — | US | disclosed |
| US-9834573-B2 | Crystalline form of benzylbenzene SGLT2 inhibitor | THERACOS SUB, LLC (US) | 2017-12-05 | — | — | US | disclosed |
| US-9725478-B2 | Process for the preparation of benzylbenzene SGLT2 inhibitors | THERACOS SUB, LLC (US) | 2017-08-08 | — | — | US | disclosed |
| US-20170183333-A1 | DERIVATIVES OF N-(ARYLAMINO) SULFONAMIDES AS INHIBITORS OF MEK | ARDEA BIOSCIENCES, INC. (US) | 2017-06-29 | — | — | US | disclosed |
| US-20170183333-A1 | DERIVATIVES OF N-(ARYLAMINO) SULFONAMIDES AS INHIBITORS OF MEK | ARDEA BIOSCIENCES, INC. (US) | 2017-06-29 | — | — | US | disclosed |
| US-9556191-B2 | Aminoquinazoline derivatives and their salts and methods of use thereof | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2017-01-31 | — | — | US | disclosed |
| US-20160355471-A1 | PREPARATION OF HYDROXY-BENZYLBENZENE DERIVATIVES | THERACOSBIO, LLC | 2016-12-08 | — | — | US | disclosed |
| US-9464043-B2 | Preparation of hydroxy-benzylbenzene derivatives | THERACOS SUB, LLC (US) | 2016-10-11 | — | — | US | disclosed |
| EP-0944623-A2 | SUBSTITUTED PYRAZOLE-3-YL BENZAZOLES | BASF AKTIENGESELLSCHAFT (DE) | 1999-09-29 | — | — | EP | disclosed |
| WO-1999031091-A1 | HERBICIDES 3-(BENZAZOL-4-YL)PYRIMIDINE-DIONE-DERIVATIVES | BASF AKTIENGESELLSCHAFT (DE) | 1999-06-24 | — | — | WO | disclosed |
| EP-0915853-A1 | SUBSTITUTED 3-PHENYL PYRAZOLES | BASF AKTIENGESELLSCHAFT (DE) | 1999-05-19 | — | — | EP | disclosed |
| WO-1999006394-A1 | SUBSTITUTED 2-(BENZOARYL)PYRIDINES | BASF AKTIENGESELLSCHAFT (DE) | 1999-02-11 | — | — | WO | disclosed |
| EP-0878458-A1 | Oxidation process of ethers | Daicel Chemical Industries, Ltd. (JP) | 1998-11-18 | — | — | EP | disclosed |
| WO-1998038169-A1 | SUBSTITUTED 3-PHENYL PYRAZOLES | BASF AKTIENGESELLSCHAFT (DE) | 1998-09-03 | — | — | WO | disclosed |
| WO-1998027090-A2 | SUBSTITUTED PYRAZOLE-3-YL BENZAZOLES | BASF AKTIENGESELLSCHAFT (DE) | 1998-06-25 | — | — | WO | disclosed |
| WO-1998007720-A1 | SUBSTITUTED 2-ARYLPYRIDINE AS HERBICIDE | BASF AKTIENGESELLSCHAFT (DE) | 1998-02-26 | — | — | WO | disclosed |
| WO-1998005649-A1 | SUBSTITUTED 3-PHENYL PYRAZOLES | BASF AKTIENGESELLSCHAFT (DE) | 1998-02-12 | — | — | WO | disclosed |
| CN-1145364-A | Heterocyclic compounds and their preparation and use | LILLY CO ELI (US) | 1997-03-19 | — | — | CN | disclosed |