⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2739848 | 0.89 | — | — | |
| SCHEMBL12118788 | 0.87 | TSHR (0.40) | — | |
| SCHEMBL567667 | 0.87 | TSHR (0.40) | — | |
| SCHEMBL5114014 | 0.83 | TSHR (0.42) | — | |
| SCHEMBL12122163 | 0.83 | TSHR (0.42) | — | |
| SCHEMBL13239946 | 0.82 | TSHR (0.40) | — | |
| SCHEMBL7553056 | 0.79 | — | — | |
| SCHEMBL3024710 | 0.79 | — | — | |
| SCHEMBL685088 | 0.78 | ALDH1A1 (0.44) | — | |
| SCHEMBL575054 | 0.78 | TSHR (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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1314765-C | Flame-retardant resin composition | POLYPLASTICS CO (JP) | 2007-05-09 | — | — | CN | disclosed |
| US-7153676-B1 | Transacylases of the paclitaxel biosynthetic pathway | WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2006-12-26 | — | — | US | disclosed |
| CN-1599776-A | Flame-retardant resin composition | POLYPLASTICS CO (JP) | 2005-03-23 | — | — | CN | disclosed |
| US-6818755-B2 | PROTEIN FOR USE IN THE GENERATION OF TAXOL AND TAXOIDS FOR USE IN THE TREATMENT OF CANCER | WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION | 2004-11-16 | — | — | US | disclosed |
| US-20040005562-A9 | Comprises tranferase protein associated with biosynthesis of taxoids for treating breast and ovarian cancers | WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION | 2004-01-08 | — | — | US | disclosed |
| US-20030108891-A1 | Transacylases of the paclitaxel biosynthetic pathway | WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION | 2003-06-12 | — | — | US | disclosed |
| US-20020168745-A1 | Protein for use in the generation of taxol and taxoids for use in the treatment of cancer | WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION | 2002-11-14 | — | — | US | disclosed |
| US-20020138859-A1 | Transacylases of the paclitaxel biosynthetic pathway | WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION | 2002-09-26 | — | — | US | disclosed |
| EP-1220930-A2 | TRANSACYLASES OF THE PACLITAXEL BIOSYNTHETIC PATHWAY | WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2002-07-10 | — | — | EP | disclosed |
| US-6287835-B1 | MOLECULAR HYBRIDIZATION; GENE EXPRESSION, GENETIC ENGINEERING | WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION | 2001-09-11 | — | — | US | disclosed |
| WO-2001023586-A2 | TRANSACYLASES OF THE PACLITAXEL BIOSYNTHETIC PATHWAY | WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2001-04-05 | — | — | WO | disclosed |
| US-5597931-A | Total synthesis of taxol and analogues thereof | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1997-01-28 | — | — | US | disclosed |
| WO-1996034862-A1 | TOTAL SYNTHESIS OF TAXOL AND ANALOGUES THEREOF | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1996-11-07 | — | — | WO | disclosed |
| US-5527924-A | ANTICARCINOGENIC AGENTS | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1996-06-18 | — | — | US | disclosed |
| US-5488116-A | Total synthesis of taxol and analogues thereof | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1996-01-30 | — | — | US | disclosed |
| US-5416225-A | Chemical intermediates | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1995-05-16 | — | — | US | disclosed |
| WO-1995012567-A1 | TOTAL SYNTHESIS OF TAXOL AND ANALOGUES THEREOF | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1995-05-11 | — | — | WO | disclosed |
| WO-1993020036-A1 | TOTAL SYNTHESIS OF TAXOL | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1993-10-14 | — | — | WO | disclosed |