⚠ 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 SCHEMBL28795350 | 0.95 | — | — | |
| SCHEMBL20586 | 0.94 | — | — | |
| SCHEMBL27977434 | 0.94 | ALDH1A1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL2251934 | 0.89 | — | — | |
| Phosphine SCHEMBL28036791 | 0.89 | — | — | |
| Water SCHEMBL8449693 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL15233791 | 0.89 | — | — | |
| Iodide SCHEMBL30960110 | 0.89 | — | — | |
| Fluoride SCHEMBL1781630 | 0.89 | — | — | |
| SCHEMBL27928241 | 0.77 | — | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002102754-A2 | PROCESS FOR THE PREPARATION OF 3-HYDROXYPROPANAL | ARCO CHEMICAL TECHNOLOGY, L.P. (US) | 2002-12-27 | — | — | WO | claimed |
| US-7670753-B2 | Lithographic printing plate precursor | EASTMAN KODAK COMPANY (US) | 2010-03-02 | — | — | US | disclosed |
| EP-1831198-B1 | PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS | ASTRAZENECA AB (SE) | 2009-04-08 | — | — | EP | disclosed |
| US-20080261146-A1 | Lithographic Printing Plate Precursor | EASTMAN KODAK COMPANY | 2008-10-23 | — | — | US | disclosed |
| EP-1782127-B1 | LITHOGRAPHIC PRINTING PLATE PRECURSOR | EASTMAN KODAK CO (US) | 2008-04-02 | — | — | EP | disclosed |
| CN-101128454-A | Pyridine carboxamide derivatives for use as anticancer agents | ASTRAZENECA AB (SE) | 2008-02-20 | — | — | CN | disclosed |
| EP-1782127-A1 | LITHOGRAPHIC PRINTING PLATE PRECURSOR | EASTMAN KODAK COMPANY (US) | 2007-05-09 | — | — | EP | disclosed |
| WO-2006023667-A1 | LITHOGRAPHIC PRINTING PLATE PRECURSOR | EASTMAN KODAK COMPANY (US) | 2006-03-02 | — | — | WO | disclosed |
| EP-0537905-B1 | Water soluble derivatives of taxol with anti-neoplastic activity | VIRGINIA TECH INTELL PROP (US) | 1996-03-06 | — | — | EP | disclosed |
| EP-0406274-B1 | WATER SOLUBLE, ANTINEOPLASTIC DERIVATIVES OF TAXOL | US HEALTH (US) | 1994-07-27 | — | — | EP | disclosed |
| US-5157049-A | Method of treating cancers sensitive to treatment with water soluble derivatives of taxol | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) | 1992-10-20 | — | — | US | disclosed |
| EP-0406274-A4 | NEW, WATER SOLUBLE, ANTINEOPLASTIC DERIVATIVES OF TAXOL | US HEALTH (US) | 1991-08-28 | — | — | EP | disclosed |
| EP-0406274-A1 | WATER SOLUBLE, ANTINEOPLASTIC DERIVATIVES OF TAXOL. | US HEALTH (US) | 1991-01-09 | — | — | EP | disclosed |
| US-4942184-A | ANTITUMOR AGENTS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1990-07-17 | — | — | US | disclosed |
| WO-1989008453-A1 | NEW, WATER SOLUBLE, ANTINEOPLASTIC DERIVATIVES OF TAXOL | THE UNITED STATES OF AMERICA, AS REPRESENTED BY TH (US) | 1989-09-21 | — | — | WO | disclosed |
| US-4314817-A | FOR DYEING TEXTILE SUBSTRATES | SANDOZ LTD. (CH) | 1982-02-09 | — | — | US | disclosed |
| EP-0022850-A4 | FUEL ADDITIVES. | CALIFORNIA TEXAS OIL CO (US) | 1981-06-16 | — | — | EP | disclosed |
| EP-0022850-A1 | FUEL ADDITIVES | CALIFORNIA-TEXAS OIL COMPANY (US) | 1981-01-28 | — | — | EP | disclosed |
| US-4244703-A | TERTIARY DIAMINES AND ALCOHOL IN A HYDROCARBON FUEL IMPROVE EFFICIENCY AND PROVIDE ANTIKNOCK PROPERTIES | CALIFORNIA-TEXAS OIL COMPANY (US) | 1981-01-13 | — | — | US | disclosed |
| WO-1980001570-A1 | FUEL ADDITIVES | CALIFORNIA TEXAS OIL CO (US) | 1980-08-07 | — | — | WO | disclosed |