⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1326082 | 0.85 | ALDH1A1 (0.56) | — | |
| SCHEMBL4950436 | 0.83 | ALDH1A1 (0.52) | — | |
| SCHEMBL15314023 | 0.82 | — | — | |
| SCHEMBL10431008 | 0.81 | ALDH1A1 (0.50) | — | |
| SCHEMBL18921549 | 0.81 | ALDH1A1 (0.41) | — | |
| SCHEMBL18921550 | 0.79 | — | — | |
| SCHEMBL2685731 | 0.77 | — | — | |
| SCHEMBL64593 | 0.76 | ALDH1A1 (0.68) | — | |
| SCHEMBL961094 | 0.75 | ALDH1A1 (0.44) | — | |
| SCHEMBL13056203 | 0.75 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102612317-B | Aqueous dispersions containing antimicrobials in a hybrid network | BASF SE | 2015-07-01 | — | — | CN | claimed |
| CN-102612317-B | Aqueous dispersions containing antimicrobials in a hybrid network | BASF SE | 2015-07-01 | — | — | CN | disclosed |
| US-8058261-B2 | 3′-ethynylcytidine derivative | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2011-11-15 | — | — | US | disclosed |
| EP-2045258-B1 | 3'-ETHYNYLCYTIDINE DERIVATIVE | TAIHO PHARMACEUTICAL CO LTD (JP) | 2011-09-21 | — | — | EP | disclosed |
| US-7825103-B2 | 5'-O-triisopropylsilyl-2'-cyano-2'-deoxy-1- beta -D-arabinofuranosylcytosine; antitumor agents | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2010-11-02 | — | — | US | disclosed |
| US-20090306008-A1 | 3'-ETHYNYLCYTIDINE DERIVATIVE | Sasaki, Takuma (JP) | 2009-12-10 | — | — | US | disclosed |
| US-20090118222-A1 | NOVEL PYRIMIDINE NUCLEOSIDE COMPOUND OR ITS SALT | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2009-05-07 | — | — | US | disclosed |
| EP-2045258-A1 | 3'-ETHYNYLCYTIDINE DERIVATIVE | Taiho Pharmaceutical Co., Ltd. (JP) | 2009-04-08 | — | — | EP | disclosed |
| EP-1845102-A1 | NOVEL PYRIMIDINE NUCLEOSIDE COMPOUND OR ITS SALT | TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-10-17 | — | — | EP | disclosed |
| EP-0962481-A2 | Sheet and tube siloxane polymers containing a pendent organofunctional group | DOW CORNING CORPORATION (US) | 1999-12-08 | — | — | EP | disclosed |
| US-5977248-A | POLYSILOXANES | DOW CORNING CORPORATION (US) | 1999-11-02 | — | — | US | disclosed |