⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8840259 | 1.00 | — | — | |
| SCHEMBL7945295 | 1.00 | — | — | |
| SCHEMBL1785472 | 0.79 | — | — | |
| SCHEMBL1785470 | 0.79 | — | — | |
| SCHEMBL2872926 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL22564645 | 0.73 | ALDH1A1 (0.31) | — | |
| SCHEMBL5843088 | 0.73 | — | — | |
| SCHEMBL9499326 | 0.73 | — | — | |
| SCHEMBL5843083 | 0.73 | — | — | |
| SCHEMBL9499322 | 0.73 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20190241822-A1 | COMPOSITION FOR REMOVING IRON SULFIDE | KURARAY CO., LTD. (JP) | 2019-08-08 | — | — | US | disclosed |
| EP-3486353-A1 | COMPOSITION FOR REMOVING IRON SULFIDE | Kuraray Co., Ltd. (JP) | 2019-05-22 | — | — | EP | disclosed |
| US-9682111-B2 | Method for preventing or treating neurodegenerative diseases | SU WEIWEI (CN) | 2017-06-20 | — | — | US | disclosed |
| US-20160082059-A1 | METHOD FOR PREVENTING OR TREATING NEURODEGENERATIVE DISEASES | SU WEIWEI (CN) | 2016-03-24 | — | — | US | disclosed |
| US-20150105460-A1 | LABDANE DITERPENOID COMPOUNDS, SEMEN BIOTAE EXTRACT, AND PREPARATION METHOD AND USE THEREOF | SU WEIWEI (CN) | 2015-04-16 | — | — | US | disclosed |
| US-6255437-B1 | POLYCARBONATE USEFUL AS MOLDING RESIN, HAVING EXCELLENT WEATHERABILITY FOR OUTDOOR APPLICATIONS AND LOW BIREFRINGENCE NEEDED FOR COMPACT DISCS | EASTMAN CHEMICAL COMPANY | 2001-07-03 | — | — | US | disclosed |
| US-6037436-A | MIXING 2,2,4,4-TETRAMETHYL-1,3-CYCLOBUTANEDIOL, DIMETHYL CARBONATE AND BASIC CATALYST, HEATING TO PRODUCE INTERMEDIATE, FOLLOWED BY HEATING INTERMEDIATE TO PRODUCE POLYCARBONATE | EASTMAN CHEMICAL COMPANY (US) | 2000-03-14 | — | — | US | disclosed |
| US-5962622-A | Process for preparing the polycarbonate of 2,2,4,4-tetramethyl-1,3-cyclobutanediol | EASTMAN CHEMICAL COMPANY (US) | 1999-10-05 | — | — | US | disclosed |
| EP-0857743-A2 | Process for preparing poly(2,2,4,4-tetramethyl-1,3-cyclobutylene carbonate) | EASTMAN CHEMICAL COMPANY (US) | 1998-08-12 | — | — | EP | disclosed |
| EP-0850970-A2 | Process for preparing the polycarbonate of 2,2,4,4-tetramethyl-1,3-cyclobutanediol | EASTMAN CHEMICAL COMPANY (US) | 1998-07-01 | — | — | EP | disclosed |