⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6378778 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL27994744 | 0.97 | — | — | |
| SCHEMBL21395233 | 0.82 | ALDH1A1 (0.39) | — | |
| SCHEMBL19123760 | 0.81 | ALDH1A1 (0.35) | — | |
| SCHEMBL15641382 | 0.80 | — | — | |
| SCHEMBL27734554 | 0.77 | — | — | |
| SCHEMBL8344089 | 0.77 | — | — | |
| SCHEMBL9461969 | 0.76 | HCAR2 (0.43) | — | |
| SCHEMBL20913012 | 0.76 | ALDH1A1 (0.40) | — | |
| SCHEMBL20913011 | 0.76 | ALDH1A1 (0.40) | — |
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 78 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2702035-B1 | PROCESS FOR CONTINUOUS FLOW SYNTHESIS OF BETA-AMINO CROTONATE | COUNCIL SCIENT IND RES (IN) | 2018-03-07 | — | — | EP | claimed |
| US-9199913-B2 | Process for continous flow synthesis of beta-amino crotonate | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2015-12-01 | — | — | US | claimed |
| EP-2702035-A2 | PROCESS FOR CONTINUOUS FLOW SYNTHESIS OF BETA-AMINO CROTONATE | Council of Scientific & Industrial Research (IN) | 2014-03-05 | — | — | EP | claimed |
| US-20140046090-A1 | PROCESS FOR CONTINOUS FLOW SYNTHESIS OF beta-AMINO CROTONATE | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2014-02-13 | — | — | US | claimed |
| WO-2012147103-A2 | PROCESS FOR CONTINUOUS FLOW SYNTHESIS OF β-ΑΜΙΝΟ CROTONATE | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2012-11-01 | — | — | WO | claimed |
| US-6784297-B2 | CONDENSING PHTHALIC ANHYDRIDE AND ETHANOLAMINE, COUPLING WITH ETHYL 4-CHLORACETOACETATE/O-CHLOROBENZALDEHYDE, CONDENSING (CYCLIZATION) WITH METHYL AMINOCROTONATE, PURIFYING, HYDROLYZING, SALT FORMING; COMMERCIALLY VIABLE; EFFICIENCY | KOPRAN LIMITED (IN) | 2004-08-31 | — | — | US | claimed |
| CN-1326470-A | Redox polymerization process | AKZO NOBEL NV (NL) | 2001-12-12 | — | — | CN | claimed |
| CN-1056509-C | Patches for percutaneous administration of skin-whitening materials | PACIFIC CHEM CO LTD (KR) | 2000-09-20 | — | — | CN | claimed |
| CN-1076110-A | Percutaneous is given so that the patch of skin-whitening materials | PACIFIC CHEM CO LTD (KR) | 1993-09-15 | — | — | CN | claimed |
| EP-4213980-A1 | AMINE MODIFIED POLYSACCHARIDE URETHANE/UREA MICROCAPSULES | Encapsys, LLC (US) | 2023-07-26 | — | — | EP | disclosed |
| WO-2022061103-A1 | AMINE MODIFIED POLYSACCHARIDE URETHANE/UREA MICROCAPSULES | ENCAPSYS, LLC (US) | 2022-03-24 | — | — | WO | disclosed |
| EP-2666538-B1 | DISPERSING AGENT, DISPERSION, METHOD FOR ADJUSTING VISCOSITY OF DISPERSION, MOBILE DEVICE, SURFACE TREATMENT AGENT, ELECTROLYTIC SOLUTION, SEPARATOR, AND RECHARGEABLE LITHIUM ION BATTERY | UNIV FUKUOKA (JP) | 2019-04-17 | — | — | EP | disclosed |
| CN-106831787-B | Compound and its preparation method and application as bruton's tyrosine kinase inhibitor | 成都倍特药业有限公司 | 2018-10-23 | — | — | CN | disclosed |
| CN-105017085-B | A kind of kcnq potassium channel agonist, preparation method and use | 中国科学院上海药物研究所 | 2018-06-29 | — | — | CN | disclosed |
| US-4983740-A | Multistep; from 2- 2-/2-chloroethoxy/ethoxy!ethanol and potassium phthalimide | ADIR ET COMPAGNIE (FR) | 1991-01-08 | — | — | US | disclosed |
| US-4870091-A | CALCIUM CHANNEL BLOCKERS | ADIR ET CIE (FR) | 1989-09-26 | — | — | US | disclosed |
| US-4603135-A | HYPOTENSIVE AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1986-07-29 | — | — | US | disclosed |
| US-4593033-A | Cardiovascular disorders | MERCK & CO., INC. (US) | 1986-06-03 | — | — | US | disclosed |
| EP-0138505-A2 | Dihydropyridine derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1985-04-24 | — | — | EP | disclosed |
| US-4022897-A | 4H-PYRIDO(1,2-A) PYRIMIDIN-4-ONE DERIVATIVES | E. R. SQUIBB & SONS, INC. (US) | 1977-05-10 | — | — | US | disclosed |