⚠ 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 | |
|---|---|---|---|---|
| Butyric Acid SCHEMBL2503 | 0.96 | — | — | |
| Butyric Acid SCHEMBL5703921 | 0.96 | FFAR3 (1.00) | — | |
| Butyric Acid SCHEMBL1332215 | 0.96 | — | — | |
| Butyric Acid SCHEMBL4446516 | 0.96 | FFAR3 (1.00) | — | |
| Butyric Acid SCHEMBL339305 | 0.96 | FFAR3 (1.00) | — | |
| Butyric Acid SCHEMBL8458708 | 0.96 | FFAR3 (1.00) | — | |
| Butyric Acid SCHEMBL991717 | 0.96 | FFAR3 (1.00) | — | |
| Butyric Acid SCHEMBL8457839 | 0.96 | FFAR3 (1.00) | — | |
| Butyric Acid SCHEMBL20678495 | 0.96 | — | — | |
| Butyric Acid SCHEMBL320515 | 0.96 | FFAR3 (1.00) | — |
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 57 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108117505-A | A kind of preparation method for synthesizing diphenyl ether imidodicarbonic diamide | 杜庶铭 | 2018-06-05 | — | — | CN | claimed |
| CN-104703960-A | Fluorine-containing ester and preparation method thereof | DU PONT | 2015-06-10 | — | — | CN | claimed |
| CN-101955436-B | Naphthyloxy benzedrine derivatives and preparation method thereof | QI YOUMAO | 2013-07-24 | — | — | CN | claimed |
| CN-101914100-B | Benzenesulfonyl lupetazin derivative and preparation method thereof | QI YOUMAO | 2013-01-30 | — | — | CN | claimed |
| CN-101870671-B | Adamantly pyrrolidine derivative, and preparation and application thereof | YOUMAO QI | 2012-06-27 | — | — | CN | claimed |
| CN-101955436-A | Naphthyloxy benzedrine derivatives and preparation method thereof | YOUMAO QI | 2011-01-26 | — | — | CN | claimed |
| CN-101914100-A | Benzenesulfonyl lupetazin derivative and preparation method thereof | YOUMAO QI | 2010-12-15 | — | — | CN | claimed |
| CN-101870698-A | Sulfonyl-phenyl imidazo triazine derivative and preparation method | YOUMAO QI | 2010-10-27 | — | — | CN | claimed |
| CN-101870699-A | Benzenesulfonyl piperazine derivative and preparation method thereof | YOUMAO QI | 2010-10-27 | — | — | CN | claimed |
| CN-101870671-A | Adamantly pyrrolidine derivative, and preparation and application thereof | YOUMAO QI | 2010-10-27 | — | — | CN | claimed |
| CN-101863891-A | Trifluoromethane triazolidine quinoxaline derivative and preparation method thereof | YOUMAO QI | 2010-10-20 | — | — | CN | claimed |
| CN-101798301-A | Pyrrolidyl pyrimidine methanesulfonamide derivatives and preparation method thereof | YOUMAO QI | 2010-08-11 | — | — | CN | claimed |
| CN-101481383-A | Cefdinir acid type double salt compound and preparation | ZHEJIANG AOMO BIOMEDICINE CO L (CN) | 2009-07-15 | — | — | CN | claimed |
| CN-100390251-C | Preparation of curcas biological diesel oil by solid phase catalytic method | UNIV GUIZHOU (CN) | 2008-05-28 | — | — | CN | claimed |
| CN-1824735-A | Preparation of curcas biological diesel oil by solid phase catalytic method | UNIV GUIZHOU (CN) | 2006-08-30 | — | — | CN | claimed |
| CN-105518046-B | Process for making polyisocyanate polyaddition polyols using a stabilizer | 陶氏环球技术有限责任公司 | 2019-07-12 | — | — | CN | disclosed |
| CN-105358599-B | For manufacturing urethane-isocyanuric acid ester method | 陶氏环球技术有限责任公司 | 2019-04-19 | — | — | CN | disclosed |
| US-5256755-A | Using rubidium and cesium carbonates and carboxylates as catalysts for condensing silicon compounds or increasing molecular weight of polysiloxanes | DOW CORNING LIMITED (GB) | 1993-10-26 | — | — | US | disclosed |
| US-5210129-A | Aftertreating polysiloxanes to increase molecular weight | DOW CORNING S.A. (BE) | 1993-05-11 | — | — | US | disclosed |
| EP-0503825-A1 | Method of making siloxane compositions | DOW CORNING S.A. (BE) | 1992-09-16 | — | — | EP | disclosed |