⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL2784565 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL13734250 | 0.96 | — | — | |
| Iodide SCHEMBL15550172 | 0.96 | — | — | |
| SCHEMBL163513 | 0.95 | — | — | |
| SCHEMBL15141903 | 0.95 | ALDH1A1 (0.33) | — | |
| SCHEMBL31094281 | 0.91 | — | — | |
| Iodide SCHEMBL3836089 | 0.91 | — | — | |
| Bromide SCHEMBL4007319 | 0.91 | — | — | |
| SCHEMBL31094282 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL2187615 | 0.91 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111298826-B | Small-grain Ni @ Silicalite-1 encapsulated catalyst and synthesis method and application thereof | 中国科学院过程工程研究所 | 2022-02-22 | — | — | CN | claimed |
| CN-111298826-A | Small-grain Ni @ Silicalite-1 encapsulated catalyst and synthesis method and application thereof | 中国科学院过程工程研究所 | 2020-06-19 | — | — | CN | claimed |
| EP-1192146-A1 | CHROMAN DERIVATIVES RESISTING NEUROLOGICAL DISORDERS | AstraZeneca UK Limited (GB) | 2002-04-03 | — | — | EP | claimed |
| WO-2000078742-A1 | CHROMAN DERIVATIVES AGAINST NEUROLOGICAL DISORDERS | ASTRAZENECA UK LIMITED (GB) | 2000-12-28 | — | — | WO | claimed |
| CN-115516577-A | Method for producing solid electrolyte | 出光兴产株式会社 | 2022-12-23 | — | — | CN | disclosed |
| CN-114127055-A | Molecular design of novel antibiotics and antibiotic adjuvants against MCR strains | 新加坡保健服务集团有限公司 | 2022-03-01 | — | — | CN | disclosed |
| CN-111298826-B | Small-grain Ni @ Silicalite-1 encapsulated catalyst and synthesis method and application thereof | 中国科学院过程工程研究所 | 2022-02-22 | — | — | CN | disclosed |
| CN-111197052-B | Cold-adapted I-type 5-enol pyruvoyl shikimic acid-3-phosphate synthase gene | 华中农业大学 | 2021-07-13 | — | — | CN | disclosed |
| CN-112243440-A | Hexahydroxypyrrolo [3,4-c ] pyrrole derivatives useful as LOX inhibitors | 癌症研究协会皇家癌症医院 | 2021-01-19 | — | — | CN | disclosed |
| CN-111298826-A | Small-grain Ni @ Silicalite-1 encapsulated catalyst and synthesis method and application thereof | 中国科学院过程工程研究所 | 2020-06-19 | — | — | CN | disclosed |
| CN-111205416-A | Preparation method of styrene-butadiene-styrene block copolymer | 山东润科化工股份有限公司 | 2020-05-29 | — | — | CN | disclosed |
| CN-107540662-B | Schizocomulin derivative and preparation method and application thereof | 中山大学 | 2020-04-24 | — | — | CN | disclosed |
| WO-2012149639-A1 | NOVEL LATE TRANSITION METAL CATALYSTS FOR SELECTIVE POLYMER FORMATION | RYERSON UNIVERSITY (CA) | 2012-11-08 | — | — | WO | disclosed |