⚠ 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 | |
|---|---|---|---|---|
| Ethyl Bromo Acetate SCHEMBL4433807 | 0.94 | ALDH1A1 (0.71) | — | |
| SCHEMBL10472630 | 0.93 | FAAH (0.69) | — | |
| SCHEMBL1037246 | 0.91 | FAAH (0.72) | — | |
| SCHEMBL2431478 | 0.91 | FAAH (0.72) | — | |
| SCHEMBL7934446 | 0.91 | FAAH (0.72) | — | |
| SCHEMBL1037235 | 0.91 | FAAH (0.72) | — | |
| SCHEMBL7453244 | 0.91 | FAAH (0.72) | — | |
| SCHEMBL6783832 | 0.91 | FAAH (0.72) | — | |
| SCHEMBL4283094 | 0.91 | FAAH (0.72) | — | |
| SCHEMBL28756088 | 0.91 | FAAH (0.72) | — |
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 811 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116655554-B | Green synthesis method of flumioxazin key intermediate | 浙江南郊化学有限公司 | 2024-10-18 | — | — | CN | claimed |
| CN-116356085-B | Aliphatic synthetic tanning agent containing hexabasic carbonyl and preparation method and application thereof | 南京工业大学 | 2024-08-16 | — | — | CN | claimed |
| CN-113980117-B | Fenpyroximate antigen and preparation method and application thereof | 西南大学 | 2024-07-12 | — | — | CN | claimed |
| CN-118186152-A | Multifunctional high-absorption chrome tanning auxiliary agent containing barbituric acid structure and preparation method thereof | 南京工业大学 | 2024-06-14 | — | — | CN | claimed |
| CN-117820460-A | Methoxypiperidine ethyl antigen and preparation method and application thereof | 西南大学 | 2024-04-05 | — | — | CN | claimed |
| CN-111902430-B | Column [5] arene for high permeability and selective artificial water channel attachment peptides, synthesis and characterization thereof | 南洋理工大学 | 2024-03-19 | — | — | CN | claimed |
| CN-116334320-B | Aliphatic synthetic tanning agent containing multifunctional groups and preparation method and application thereof | 南京工业大学 | 2024-02-13 | — | — | CN | claimed |
| CN-115028552-B | Azidation reagent and preparation method and application thereof | 南京工业大学 | 2024-01-12 | — | — | CN | claimed |
| EP-3464237-B1 | NOVEL PROCESS FOR THE PREPARATION OF GADOLINIUM COMPLEX OF (4S)-4-(4-ETHOXYBENZYL)-3,6,9-TRIS(CARBOXYLATOMETHYL)-3,6,9- TRIAZAUNDECANEDIOIC ACID DISODIUM (GADOXETATE DISODIUM) | BIOPHORE INDIA PHARMACEUTICALS PVT LTD (IN) | 2023-12-20 | — | — | EP | claimed |
| CN-116655554-A | Green synthesis method of flumioxazin key intermediate | 浙江南郊化学有限公司 | 2023-08-29 | — | — | CN | claimed |
| CN-103709131-A | Quercetin derivatives and synthetic method thereof | UNIV NANCHANG | 2014-04-09 | — | — | CN | claimed |
| CN-103464049-A | Perfluorohexyl sulfonyloxy benzyl cation surfactant as well as preparation method and application thereof | UNIV HUAZHONG NORMAL | 2013-12-25 | — | — | CN | claimed |
| CN-103420949-A | Separation method for epichlorohydrin | CHINA PETROLEUM & CHEMICAL | 2013-12-04 | — | — | CN | claimed |
| CN-103420946-A | Separation method for epichlorohydrin | CHINA PETROLEUM & CHEMICAL | 2013-12-04 | — | — | CN | claimed |
| CN-101462992-B | Method for manufacturing thiodiglycolic dialkyl esters | SALTIGO GMBH | 2013-11-06 | — | — | CN | claimed |
| CN-102746346-A | Fullerene monosaccharide derivative using carbon atoms as connection points and preparation method thereof | UNIV HARBIN ENG | 2012-10-24 | — | — | CN | claimed |
| WO-2011101861-A1 | PROCESS FOR PREPARATION OF DPP-IV INHIBITORS | MSN LABORATORIES LIMITED (IN) | 2011-08-25 | — | — | WO | claimed |
| CN-101462992-A | Method for manufacturing thiodiglycolic dialkyl esters | SALTIGO GMBH (DE) | 2009-06-24 | — | — | CN | claimed |
| US-5296634-A | Method for preparing 4-alkylsulfonyl-2-chloro-m-xylene | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1994-03-22 | — | — | US | claimed |
| EP-0481428-A1 | Method for preparing 4-alkylsulfonyl-2-chloro-M-xylene | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1992-04-22 | — | — | EP | claimed |