⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5053526 | 0.76 | HCAR2 (0.48) | — | |
| SCHEMBL4624715 | 0.76 | CYP1A2 (0.33) | — | |
| SCHEMBL16038719 | 0.73 | — | — | |
| SCHEMBL16038720 | 0.73 | — | — | |
| SCHEMBL23603988 | 0.65 | CYP1A2 (0.38) | — | |
| SCHEMBL14400223 | 0.65 | CYP1A2 (0.38) | — | |
| SCHEMBL3260748 | 0.64 | TSHR (0.44) | — | |
| Fumaric Acid SCHEMBL15689651 | 0.63 | TSHR (0.75) | — | |
| Maleic Acid SCHEMBL8032158 | 0.63 | TSHR (0.75) | — | |
| Fumaric Acid SCHEMBL9474609 | 0.63 | TSHR (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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1738397-A2 | TARGET FOR LASER DESORPTION/IONISATION MASS SPECTROMETRY | Physikalisches Büro Steinmüller GmbH (AT) | 2007-01-03 | — | — | EP | claimed |
| WO-2005096346-A2 | TARGET FOR LASER DESORPTION/IONISATION MASS SPECTROMETRY | PHYSIKALISCHES BÜRO STEINMÜLLER GMBH (AT) | 2005-10-13 | — | — | WO | claimed |
| EP-2840116-B1 | RUBBER GRAFT COPOLYMER, AND THERMOPLASTIC RESIN COMPOSITION CONTAINING RUBBER GRAFT COPOLYMER | KANEKA CORP (JP) | 2019-01-02 | — | — | EP | disclosed |
| US-10138314-B2 | Rubber graft copolymer, and thermoplastic resin composition containing rubber graft copolymer | KANEKA CORPORATION (JP) | 2018-11-27 | — | — | US | disclosed |
| US-20150065651-A1 | RUBBER GRAFT COPOLYMER, AND THERMOPLASTIC RESIN COMPOSITION CONTAINING RUBBER GRAFT COPOLYMER | KANEKA CORPORATION (JP) | 2015-03-05 | — | — | US | disclosed |
| EP-2840116-A1 | RUBBER GRAFT COPOLYMER, AND THERMOPLASTIC RESIN COMPOSITION CONTAINING RUBBER GRAFT COPOLYMER | Kaneka Corporation (JP) | 2015-02-25 | — | — | EP | disclosed |