⚠ 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 SCHEMBL10990376 | 0.97 | — | — | |
| SCHEMBL68724 | 0.84 | TSHR (0.44) | — | |
| SCHEMBL10186900 | 0.79 | — | — | |
| SCHEMBL8563840 | 0.79 | — | — | |
| SCHEMBL5404640 | 0.78 | KDM4E (0.41) | — | |
| SCHEMBL7227356 | 0.78 | — | — | |
| Nitroacetic Acid SCHEMBL953175 | 0.77 | LMNA (0.46) | — | |
| Nitroacetic Acid SCHEMBL16673169 | 0.77 | LMNA (0.46) | — | |
| SCHEMBL31412046 | 0.76 | KDM4E (0.39) | — | |
| Nitroacetic Acid SCHEMBL11355336 | 0.75 | CA1 (0.42) | — |
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 257 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116947851-A | 8-acylmethylene berberine derivative, and preparation method and application thereof | 上海应用技术大学 | 2023-10-27 | — | — | CN | claimed |
| CN-108349866-B | Process for producing terephthalic acid | 沙特基础工业全球技术有限公司 | 2022-08-26 | — | — | CN | claimed |
| EP-3092222-A1 | IMPROVED FINGOLIMOD PROCESS | Emcure Pharmaceuticals Limited (IN) | 2016-11-16 | — | — | EP | claimed |
| WO-2015107548-A1 | IMPROVED FINGOLIMOD PROCESS | EMCURE PHARMACEUTICALS LIMITED (IN) | 2015-07-23 | — | — | WO | claimed |
| EP-2560939-A2 | NOVEL PROCESS FOR PREPARING PHENYLCYCLOPROPYLAMINE DERIVATIVES USING NOVEL INTERMEDIATES | Actavis Group Ptc Ehf (IS) | 2013-02-27 | — | — | EP | claimed |
| WO-2011132083-A2 | NOVEL PROCESS FOR PREPARING PHENYLCYCLOPROPYLAMINE DERIVATIVES USING NOVEL INTERMEDIATES | ACTAVIS GROUP PTC EHF (IS) | 2011-10-27 | — | — | WO | claimed |
| US-7557250-B1 | Picric acid explosive compound and environmentally friendly methods for making the same | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF THE NAVY (US) | 2009-07-07 | — | — | US | claimed |
| US-7539006-B2 | Electrolytic solution for driving electrolytic capacitor and electrolytic capacitor | RUBYCON CORPORATION (JP) | 2009-05-26 | — | — | US | claimed |
| US-7531702-B1 | Picric acid explosive compound and environmentally friendly methods for making the same | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2009-05-12 | — | — | US | claimed |
| CN-100456398-C | Electrolyte for driving electrolytic capacitor and electrolytic capacitor | RUBYCON CORP (JP) | 2009-01-28 | — | — | CN | claimed |
| CN-1041939-A | New fluorine methoxyphenyl dihydropyridine, its preparation method and its application aspect medicine | BAYER AG (DE) | 1990-05-09 | — | — | CN | claimed |
| CN-1040192-A | New fluorine methoxyphenyl dihydropyridine, its preparation method and the application aspect medicine | BAYER AG (DE) | 1990-03-07 | — | — | CN | claimed |
| EP-0164010-B1 | 3-NITRO-DIHYDROPYRIDINES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE | BAYER AG (DE) | 1989-02-22 | — | — | EP | claimed |
| EP-0139859-B1 | 1,4-DIHYDROPYRIDINES, METHOD FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | BAYER AG (DE) | 1988-10-19 | — | — | EP | claimed |
| CN-85101692-A | Prepare method of 3-nitro-dihydro-pyridine and uses thereof | — | 1987-01-24 | — | — | CN | claimed |
| US-4621165-A | Process for removing certain linear isoprene trimers from a mixture of isoprene trimers | RHONE-POULENC SANTE (FR) | 1986-11-04 | — | — | US | claimed |
| EP-0118354-B1 | CHEMICAL PROCESS FOR THE PURIFICATION OF A MIXTURE OF ISOPRENE TRIMERS | RHONE-POULENC SANTE (FR) | 1985-10-23 | — | — | EP | claimed |
| EP-0118354-A1 | Chemical process for the purification of a mixture of isoprene trimers | RHONE-POULENC SANTE (FR) | 1984-09-12 | — | — | EP | claimed |
| US-4129554-A | PICRIC ACID, QUINONE, CHLORANIL, CYANOACETATE ESTER | HITACHI CHEMICAL CO., LTD. (JP) | 1978-12-12 | — | — | US | claimed |
| US-4092327-A | Preparation of isoxazolines | TEXACO INC. (US) | 1978-05-30 | — | — | US | claimed |