⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31259143 | 0.91 | — | — | |
| SCHEMBL5347884 | 0.89 | MEN1 (0.33) | — | |
| SCHEMBL8521845 | 0.86 | — | — | |
| SCHEMBL28251918 | 0.84 | — | — | |
| SCHEMBL27677591 | 0.84 | — | — | |
| SCHEMBL13157265 | 0.84 | POLB (0.34) | — | |
| SCHEMBL1767501 | 0.84 | CYP3A4 (0.31) | — | |
| SCHEMBL1044296 | 0.84 | CYP3A4 (0.34) | — | |
| SCHEMBL28199374 | 0.82 | PKM (0.32) | — | |
| SCHEMBL4229895 | 0.79 | MAPK1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20020058719-A1 | SILICONE RUBBER SPONGE COMPOSITION AND SILICONE RUBBER SPONGE OBTAINED THEREFROM | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-05-16 | — | — | US | disclosed |
| US-6387971-B1 | Which cure into silicone rubber sponges suitable for use as building gaskets, sponge rolls, thermal insulating sheets | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-05-14 | — | — | US | disclosed |