⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22555588 | 0.80 | ALDH1A1 (0.48) | — | |
| SCHEMBL9705084 | 0.75 | — | — | |
| SCHEMBL11114088 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL8511701 | 0.73 | — | — | |
| SCHEMBL2883446 | 0.73 | — | — | |
| SCHEMBL8509240 | 0.73 | — | — | |
| SCHEMBL25702013 | 0.71 | — | — | |
| SCHEMBL15008001 | 0.69 | — | — | |
| SCHEMBL8510236 | 0.69 | — | — | |
| SCHEMBL621375 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7652118-B2 | Polycarbosilane and method for producing same | TOAGOSEI CO., LTD. (JP) | 2010-01-26 | — | — | US | claimed |
| US-7652118-B2 | Polycarbosilane and method for producing same | TOAGOSEI CO., LTD. (JP) | 2010-01-26 | — | — | US | disclosed |
| US-20070299232-A1 | Polycarbosilane and Method for Producing Same | TOAGOSEI CO., LTD. (JP) | 2007-12-27 | — | — | US | disclosed |
| EP-1770111-A1 | POLYCARBOSILANE AND METHOD FOR PRODUCING SAME | TOAGOSEI CO., LTD. (JP) | 2007-04-04 | — | — | EP | disclosed |