⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2864343 | 0.65 | — | — | |
| SCHEMBL9770862 | 0.60 | — | — | |
| SCHEMBL1134720 | 0.60 | — | — | |
| SCHEMBL11266654 | 0.57 | — | — | |
| SCHEMBL17490272 | 0.56 | CDC25B (0.41) | — | |
| Hexamethylbenzene SCHEMBL114857 | 0.54 | RXFP1 (0.33) | — | |
| SCHEMBL12440768 | 0.52 | — | — | |
| Hexamethylbenzene SCHEMBL10952799 | 0.49 | RXFP1 (0.31) | — | |
| Hexamethylbenzene SCHEMBL10952629 | 0.49 | RXFP1 (0.31) | — | |
| Hexamethylbenzene SCHEMBL10608743 | 0.49 | RXFP1 (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0707013-B1 | CATALYST FOR PRODUCING STYRENE POLYMER AND PROCESS FOR PRODUCING STYRENE POLYMER USING THE SAME | IDEMITSU KOSAN CO (JP) | 1999-11-24 | — | — | EP | disclosed |
| US-5747614-A | Catalyst for producing sytrenic polymer and process for producing sytrenic polymer by using same | IDEMITSU KOSAN CO., LTD. (JP) | 1998-05-05 | — | — | US | disclosed |
| EP-0707013-A1 | CATALYST FOR PRODUCING STYRENE POLYMER AND PROCESS FOR PRODUCING STYRENE POLYMER USING THE SAME | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1996-04-17 | — | — | EP | disclosed |