⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL347007 | 0.85 | PPP5C (0.31) | — | |
| SCHEMBL9844098 | 0.68 | PPP5C (0.33) | — | |
| Bicarbonate SCHEMBL3257313 | 0.66 | PPP5C (0.41) | — | |
| SCHEMBL754708 | 0.65 | SLC6A12 (0.43) | — | |
| SCHEMBL8630429 | 0.62 | PPP5C (0.38) | — | |
| SCHEMBL11273359 | 0.62 | PPP5C (0.38) | — | |
| SCHEMBL8401951 | 0.60 | PPP5C (0.40) | — | |
| SCHEMBL1315967 | 0.60 | OGA (0.34) | — | |
| SCHEMBL1965966 | 0.59 | PPP5C (0.30) | — | |
| SCHEMBL11764057 | 0.59 | PPP5C (0.34) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1237980-A1 | PHOTOINITIATOR SYSTEM WITH TITANOCENE INITIATORS | S & C Polymer Silicon- und Composite-Spezialitäten GmbH (DE) | 2002-09-11 | — | — | EP | disclosed |
| WO-2001044343-A1 | PHOTOINITIATOR SYSTEM WITH TITANOCENE INITIATORS | S & C POLYMER SILICON- UND COMPOSITE SPEZIALITÄTEN GMBH (DE) | 2001-06-21 | — | — | WO | disclosed |