⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27833417 | 1.00 | KMT2A (0.45) | — | |
| Ammonia Solution, Strong SCHEMBL15742962 | 0.97 | — | — | |
| Allyl Alcohol SCHEMBL28109758 | 0.89 | TSHR (0.45) | — | |
| Trimethylammonium SCHEMBL1905840 | 0.89 | KMT2A (0.43) | — | |
| Urea SCHEMBL11500350 | 0.87 | MAPT (0.38) | — | |
| Ether SCHEMBL7670691 | 0.85 | KMT2A (0.52) | — | |
| SCHEMBL9323219 | 0.83 | CYP3A4 (0.38) | — | |
| SCHEMBL27471975 | 0.78 | ALDH1A1 (0.69) | — | |
| SCHEMBL10497073 | 0.78 | CYP3A4 (0.35) | — | |
| SCHEMBL1101163 | 0.71 | — | — |
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
Appears in 6518 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118307413-A | Method for preparing C6-C10 alkyl nitrite by continuous flow process | 湖北景深安全技术有限公司 | 2024-07-09 | — | — | CN | claimed |
| CN-118255646-A | Preparation method of clean 3,4, 5-trifluoro-bromobenzene | 江苏联化科技有限公司 | 2024-06-28 | — | — | CN | claimed |
| CN-112219299-B | Cellulose-based self-supporting film for lithium ion battery pack | 魁北克电力公司 | 2024-06-25 | — | — | CN | claimed |
| WO-2024126998-A1 | COMPOSITION, METHOD AND USE | INNOSPEC LIMITED (GB) | 2024-06-20 | — | — | WO | claimed |
| CN-118184714-A | Method for preparing ticagrelor Lei Gao-level intermediate through continuous flow reaction | 浙江工业大学 | 2024-06-14 | — | — | CN | claimed |
| WO-2024121871-A1 | GENETIC MODIFICATION OF MICROBES FOR PRODUCTION OF NITROGEN AND CARBON-CONTAINING COMPOUNDS | FERTIS INDIA PVT. LTD. (IN) | 2024-06-13 | — | — | WO | claimed |
| EP-4371990-A1 | METHOD FOR PRODUCING AROMATIC DIHALOGEN COMPOUND | TOYOBO CO., LTD. (JP) | 2024-05-22 | — | — | EP | claimed |
| US-11986597-B2 | Nitric oxide generating systems for inhalation | NOTA Laboratories, LLC (US) | 2024-05-21 | — | — | US | claimed |
| US-20240150665-A1 | COMPOSITION, METHOD AND USE | INNOSPEC LIMITED (GB) | 2024-05-09 | — | — | US | claimed |
| CN-117986232-A | Oxime ester photoinitiator, preparation method and application thereof | 常州强力电子新材料股份有限公司 | 2024-05-07 | — | — | CN | claimed |
| US-4129562-A | ANTIBACTERIAL AGENTS WITH LOW TOXICITY | GRUPPO LEPETIT S.P.A. (IT) | 1978-12-12 | — | — | US | claimed |
| US-4064175-A | OXIDATION, ORGANIC NITRITE INITIATOR | TEXACO INC. (US) | 1977-12-20 | — | — | US | claimed |
| US-4053527-A | REACTING HALONITROANILINES WITH ALCOHOLS AND NITROSATING AGENTS ION | BASF AKTIENGESELLSCHAFT (DT) | 1977-10-11 | — | — | US | claimed |
| US-4045422-A | NITROSATING AN ALKOXYALKENE | ALLIED CHEMICAL CORPORATION (US) | 1977-08-30 | — | — | US | claimed |
| US-3998882-A | NITROSATION OF CYCLOALKANONES IN SULFUR DIOXIDE, SULFOLANE, NITRO-METHANE OR -BENZENE OR ALCOHOL | ALLIED CHEMICAL CORPORATION (US) | 1976-12-21 | — | — | US | claimed |
| US-3966813-A | Process for the preparation of 1-(m- and p-hydroxyphenyl)-2-aminoethanol | WARNER-LAMBERT COMPANY (US) | 1976-06-29 | — | — | US | claimed |
| US-3966974-A | LESS PRODUCTION OF NITROSAMINES | CANADA PACKERS LIMITED (CA) | 1976-06-29 | — | — | US | claimed |
| US-3960843-A | Process for the preparation of esters of N-blocked penicillin acids which comprises reacting the acid or a salt thereof with a primary amine and a nitrosating agent | GLAXO LABORATORIES LIMITED (EN) | 1976-06-01 | — | — | US | claimed |
| US-3941768-A | One step diazotization coupling process | CIBA-GEIGY AG (CH) | 1976-03-02 | — | — | US | claimed |
| US-3941823-A | NITROSATION OF AN IMIDO-ESTER OR -THIOESTER | TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) | 1976-03-02 | — | — | US | claimed |