⚠ 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 SCHEMBL28392789 | 0.97 | — | — | |
| Bromide SCHEMBL28393345 | 0.97 | — | — | |
| Carbamic Acid SCHEMBL28102186 | 0.84 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL976980 | 0.79 | TP53 (0.41) | — | |
| Syringol SCHEMBL28090900 | 0.77 | KDM4E (0.50) | — | |
| SCHEMBL4935890 | 0.77 | — | — | |
| SCHEMBL14869531 | 0.76 | LMNA (0.43) | — | |
| SCHEMBL11699170 | 0.76 | — | — | |
| SCHEMBL6427468 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL29184275 | 0.74 | — | — |
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 346 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114539276-B | 2,4,6, 8-Tetrasubstituted-2, 4,6, 8-tetraazaadamantane-9, 10-dione diethylene glycol | 南京理工大学 | 2024-11-29 | — | — | CN | claimed |
| CN-114539277-B | 2,4,6, 8-Tetrasubstituted-2, 4,6, 8-tetraazanoradamantan-9-one ethylene glycol | 南京理工大学 | 2024-11-29 | — | — | CN | claimed |
| CN-118978525-A | Light-activated labeled RNA photosensitizer based on phenothiazine, and preparation method and application thereof | 大连理工大学宁波研究院 | 2024-11-19 | — | — | CN | claimed |
| CN-114539276-A | 2,4,6, 8-tetrasubstituted-2, 4,6, 8-tetraazaadamantane-9, 10-dione diethylene glycol | 南京理工大学 | 2022-05-27 | — | — | CN | claimed |
| CN-114539277-A | 2,4,6, 8-tetrasubstituted-2, 4,6, 8-tetraazanoradamantan-9-one ethylene glycol | 南京理工大学 | 2022-05-27 | — | — | CN | claimed |
| WO-2022088295-A1 | FLUORESCENT REDUCED GRAPHENE OXIDE, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 华侨大学 | 2022-05-05 | — | — | WO | claimed |
| WO-2022063312-A1 | HYALURONIC ACID HYDROGEL AND HYALURONIC ACID FILM, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF | 吾奇生物医疗科技(江苏)有限公司 | 2022-03-31 | — | — | WO | claimed |
| CN-110669075-B | Mo/W/Ta ternary mixed polyoxometallate and application thereof in photocatalytic primary amine coupling reaction | 河南师范大学 | 2022-02-22 | — | — | CN | claimed |
| US-20210206644-A1 | SUBSTITUTED GRAPHANE MATERIAL WITH THREE-DIMENSIONAL STRUCTURE AND PREPARATION METHOD THEREOF | HUAQIAO UNIVERSITY (CN) | 2021-07-08 | — | — | US | claimed |
| WO-2020140529-A1 | PSEUDOPEPTIDE, PREPARATION METHOD THEREFOR, AND USES THEREOF | 京东方科技集团股份有限公司 | 2020-07-09 | — | — | WO | claimed |
| WO-2006071017-A1 | QUINAZOLINE DERIVATIVES FOR INHIBITING CANCER CELL GROWTH AND METHOD FOR THE PREPARATION THEREOF | HANMI PHARM. CO., LTD. (KR) | 2006-07-06 | — | — | WO | claimed |
| EP-1479683-B1 | Process for the synthesis of hexanitrohexaazaisowurtzitane in 2 steps from a primary amine | SNPE MATERIAUX ENERGETIQUES (FR) | 2005-10-26 | — | — | EP | claimed |
| WO-2000044216-A2 | GAMBOGIC ACID, ANALOGS AND DERIVATIVES AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS | CYTOVIA INC (US) | 2000-08-03 | — | — | WO | claimed |
| EP-0120585-B1 | FUSED HETEROCYCLIC COMPOUNDS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1987-12-16 | — | — | EP | claimed |
| EP-0081955-B1 | BENZO-FUSED HETEROCYCLIC COMPOUNDS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1987-01-21 | — | — | EP | claimed |
| EP-0117196-B1 | DERIVATIVES OF N-IMINOPYRIDINIUM BETAINES, THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | PROVESAN S.A. (CH) | 1986-07-30 | — | — | EP | claimed |
| US-4563467-A | ANTIEDEMIC, LACTATION BLOCKERS | PROVESAN S.A. (CH) | 1986-01-07 | — | — | US | claimed |
| EP-0117196-A1 | Derivatives of N-iminopyridinium betaines, their preparation and their use as medicaments | PROVESAN S.A. (CH) | 1984-08-29 | — | — | EP | claimed |
| EP-0004938-B1 | PROCESS FOR THE PREPARATION OF SEMISYNTHETIC BETA-LACTAM ANTIBIOTICS | BAYER AG (DE) | 1981-06-03 | — | — | EP | claimed |
| US-4229349-A | Production of semi-synthetic β-lactam antibiotics | BAYER AKTIENGESELLSCHAFT (DE) | 1980-10-21 | — | — | US | claimed |