⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6177309 | 0.98 | ALDH1A1 (0.33) | — | |
| SCHEMBL18373701 | 0.76 | — | — | |
| SCHEMBL29620985 | 0.75 | — | — | |
| SCHEMBL2955400 | 0.75 | ACHE (0.35) | — | |
| SCHEMBL4928856 | 0.75 | — | — | |
| SCHEMBL29502328 | 0.75 | — | — | |
| SCHEMBL14982710 | 0.73 | — | — | |
| SCHEMBL6136491 | 0.73 | — | — | |
| SCHEMBL29993495 | 0.73 | HTT (0.32) | — | |
| SCHEMBL11258812 | 0.73 | RAB9A (0.33) | — |
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 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230303495-A9 | PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF | SHANGHAI JEYOU PHARMACEUTICAL CO., LTD. (CN) | 2023-09-28 | — | — | US | disclosed |
| US-20220388999-A1 | NITROCATECHOL DERIVATIVES AS COMT INHIBITORS | BIAL PORTELA & CA SA (PT) | 2022-12-08 | — | — | US | disclosed |
| CN-106478497-B | Arylamine derivatives as TTX-S blockers | 拉夸里亚创药株式会社 | 2020-05-08 | — | — | CN | disclosed |
| EP-2831042-B1 | HETEROARYL COMPOUNDS WITH A-CYCLIC BRIDGING UNIT | INTERVET INT BV (NL) | 2019-07-31 | — | — | EP | disclosed |
| US-20180065932-A1 | ANTIVIRAL COMPOUNDS | ALIOS BIOPHARMA, INC. | 2018-03-08 | — | — | US | disclosed |
| US-20170362213-A1 | NITROCATECHOL DERIVATIVES AS COMT INHIBITORS | PORTELA & COMPANHIA, S.A. (PT) | 2017-12-21 | — | — | US | disclosed |
| EP-2464228-B1 | SUBSTITUTED CYCLOPROPYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | MERCK SHARP & DOHME (US) | 2017-12-06 | — | — | EP | disclosed |
| US-20170095458-A1 | HETEROARYL SULFONAMIDES AND CCR2/CCR9 | CHEMOCENTRYX, INC. (US) | 2017-04-06 | — | — | US | disclosed |
| US-9550759-B2 | Nitrocatechol derivatives as COMT inhibitors | BIAL—PORTELA & CA, S.A. (PT) | 2017-01-24 | — | — | US | disclosed |
| EP-2630122-B1 | ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS | RAQUALIA PHARMA INC (JP) | 2016-11-30 | — | — | EP | disclosed |
| WO-1998030542-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-07-16 | — | — | WO | disclosed |
| WO-1998014192-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-04-09 | — | — | WO | disclosed |
| EP-0627421-B1 | Method of preparing 2-chloro-pyridinemethanol | CENTRAL GLASS CO LTD (JP) | 1997-08-13 | — | — | EP | disclosed |
| US-5440047-A | Method of preparing 2-chloro-pyridinemethanol | CENTRAL GLASS COMPANY, LIMITED (JP) | 1995-08-08 | — | — | US | disclosed |
| EP-0627421-A1 | Method of preparing 2-chloro-pyridinemethanol | CENTRAL GLASS COMPANY, LIMITED (JP) | 1994-12-07 | — | — | EP | disclosed |
| US-4585871-A | Process for oxidizing halopyridines to halopyridine-N-oxides | OLIN CORPORATION (US) | 1986-04-29 | — | — | US | disclosed |
| US-4504667-A | Process for oxidizing halopyridines to halopyridine-N-oxides | OLIN CORPORATION (US) | 1985-03-12 | — | — | US | disclosed |
| EP-0130333-A1 | Process for oxidizing halopyridines to halopyridine-N-oxides | OLIN CORPORATION (US) | 1985-01-09 | — | — | EP | disclosed |
| EP-0090177-A1 | Process for oxidizing halopyridines to halopyridine-N-oxides | OLIN CORPORATION (US) | 1983-10-05 | — | — | EP | disclosed |
| EP-0036638-A2 | Herbicidal and plant growth regulant 2-sulfinyl and 2-sulfonyl pyridine N-oxides | DIAMOND SHAMROCK CORPORATION (US) | 1981-09-30 | — | — | EP | disclosed |