⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4063689 | 0.81 | ALDH1A1 (0.37) | — | |
| SCHEMBL4063697 | 0.81 | ALDH1A1 (0.37) | — | |
| SCHEMBL2511413 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL3453406 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL2898862 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL3778455 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL3453404 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL2511411 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL30418037 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL3003651 | 0.74 | ALDH1A1 (0.32) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113166156-B | Tyrosine kinase inhibitors, compositions and methods | 贝达药业股份有限公司 | 2024-02-27 | — | — | CN | claimed |
| CN-114634491-B | Polycyclic compound for inhibiting RNA helicase DHX33 | 成都开悦生命科技有限公司 | 2024-03-19 | — | — | CN | disclosed |
| CN-113166156-B | Tyrosine kinase inhibitors, compositions and methods | 贝达药业股份有限公司 | 2024-02-27 | — | — | CN | disclosed |
| CN-110291095-B | Adenosine analogues and their use in regulating circadian clock | 北京生命科学研究所 | 2023-04-18 | — | — | CN | disclosed |
| CN-114634491-A | Polycyclic compound for inhibiting RNA helicase DHX33 | 成都开悦生命科技有限公司 | 2022-06-17 | — | — | CN | disclosed |
| CN-106458923-B | Heterocyclic compound | 株式会社大熊制药 | 2019-09-10 | — | — | CN | disclosed |
| US-20190261891-A1 | BREATH ANALYSIS DEVICE | INVOY HOLDINGS INC. | 2019-08-29 | — | — | US | disclosed |
| US-10226201-B2 | Flow regulation device for breath analysis and related method | INVOY HOLDINGS, LLC (US) | 2019-03-12 | — | — | US | disclosed |
| US-20170224251-A1 | BREATH ANALYSIS SYSTEM CAPABLE OF CONTROLLING FLOW OF AN EXHALED BREATH SAMPLE INTO AN INSERTABLE CARTRIDGE | INVOY HOLDINGS, LLC | 2017-08-10 | — | — | US | disclosed |
| US-20170119279-A1 | FLOW REGULATION DEVICE FOR BREATH ANALYSIS AND RELATED METHOD | INVOY HOLDINGS INC. | 2017-05-04 | — | — | US | disclosed |
| US-20170119280-A1 | FLOW REGULATION DEVICE FOR BREATH ANALYSIS AND RELATED METHOD | INVOY HOLDINGS, LLC | 2017-05-04 | — | — | US | disclosed |
| CN-106458923-A | Novel heterocyclic compound | 株式会社大熊制药 | 2017-02-22 | — | — | CN | disclosed |
| EP-2411009-B1 | Therapeutic uses of quinazolinedione derivatives | SANOFI SA (FR) | 2013-03-20 | — | — | EP | disclosed |
| WO-2012142067-A2 | FORMULATIONS, SALTS, AND SOLID FORMS OF SUBSTITUTED CYCLOHEXYLMETHANAMINES, PROCESSES FOR PREPARATION, AND USES THEREOF | SUNOVION PHARMACEUTICALS INC. (US) | 2012-10-18 | — | — | WO | disclosed |
| WO-2006056930-A2 | NOVEL 4 -AMINOPIPERIDINE DERIVATIVES AS PLASMEPSIN II INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2006-06-01 | — | — | WO | disclosed |
| US-5466763-A | High performance epoxy resin modified by a polysulfide polymer derived from the heavy ends waste of chlorinated hydrocarbon production | FORMOSA PLASTICS CORPORATION (US) | 1995-11-14 | — | — | US | disclosed |
| US-5432257-A | Process for manufacturing a polysulfide polymer from the heavy ends waste of chlorinated hydrocarbon production | FORMOSA PLASTICS CORPORATION (US) | 1995-07-11 | — | — | US | disclosed |
| US-4025495-A | POLLUTION CONTROL | TESSENDERLO CHEMIE S.A. (BE) | 1977-05-24 | — | — | US | disclosed |
| US-4005156-A | Novel flame retardant compositions of matter | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1977-01-25 | — | — | US | disclosed |