⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28425745 | 0.90 | — | — | |
| SCHEMBL2004307 | 0.90 | — | — | |
| SCHEMBL17002465 | 0.88 | CYP2D6 (0.41) | — | |
| SCHEMBL15630429 | 0.88 | CYP2D6 (0.41) | — | |
| SCHEMBL17002464 | 0.88 | CYP2D6 (0.41) | — | |
| SCHEMBL15594589 | 0.88 | CYP2D6 (0.41) | — | |
| SCHEMBL28071825 | 0.88 | — | — | |
| SCHEMBL11137252 | 0.69 | — | — | |
| SCHEMBL31298643 | 0.65 | — | — | |
| SCHEMBL16763803 | 0.65 | L3MBTL1 (0.39) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105131000-A | Preparation method of spiral bispyrrolidinium bis-fluorosulfonyl imide | JIANGSU HUASHENG FINE CHEMICAL CO LTD | 2015-12-09 | — | — | CN | claimed |
| US-11279815-B2 | Compositions and methods for improving polymer flow rate | Inovia Materials LLC (US) | 2022-03-22 | — | — | US | disclosed |
| US-20210253827-A1 | COMPOSITIONS AND METHODS FOR IMPROVING POLYMER FLOW RATE | INOVIA MATERIALS (HANGZHOU) CO. LTD (CN) | 2021-08-19 | — | — | US | disclosed |
| CN-110606848-A | 5-azaindole derivative Bruton's tyrosine kinase inhibitor and preparation method and application thereof | 药雅科技(上海)有限公司 | 2019-12-24 | — | — | CN | disclosed |
| CN-105131000-A | Preparation method of spiral bispyrrolidinium bis-fluorosulfonyl imide | JIANGSU HUASHENG FINE CHEMICAL CO LTD | 2015-12-09 | — | — | CN | disclosed |
| CN-101316844-A | Inhibitors of diacylglycerol acyltransferase (DGAT) | HOFFMANN LA ROCHE (CH) | 2008-12-03 | — | — | CN | disclosed |
| WO-2008109681-A2 | METHODS AND INTERMEDIATES FOR SYNTHESIS OF SELECTIVE DPP-IV INHIBITORS | PHENOMIX CORPORATION (US) | 2008-09-12 | — | — | WO | disclosed |
| WO-2004101533-A1 | 1, 3, 4-BENZOTRIAZEPIN-2-ONE SALTS AND THEIR USE AS CCK RECEPTOR LIGANDS | JANSSEN PHARMACEUTICA, N.V. (US) | 2004-11-25 | — | — | WO | disclosed |