⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13620939 | 0.86 | — | — | |
| SCHEMBL3897308 | 0.81 | — | — | |
| SCHEMBL18163821 | 0.80 | — | — | |
| SCHEMBL5610682 | 0.75 | — | — | |
| SCHEMBL13378023 | 0.75 | ALDH1A1 (0.30) | — | |
| SCHEMBL12587990 | 0.75 | ALDH1A1 (0.30) | — | |
| SCHEMBL19574239 | 0.70 | — | — | |
| SCHEMBL11246510 | 0.70 | — | — | |
| SCHEMBL20610170 | 0.69 | PTPN1 (0.32) | — | |
| SCHEMBL25504372 | 0.69 | ALDH1A1 (0.32) | — |
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-8188202-B2 | Making polymers based on monomer 9,9-Diallylfluorene; diallyl groups form cyclohexane ring upon polymerization; superior heat resistance; use of diimine-based nickel complex catalyst, organoaluminum, and boron compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-05-29 | — | — | US | disclosed |
| US-7799886-B2 | Diene polymer and production process thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-09-21 | — | — | US | disclosed |
| US-20100234546-A1 | DIENE POLYMER AND PRODUCTION PROCESS THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-09-16 | — | — | US | disclosed |
| US-20090221774-A1 | DIENE POLYMER AND PRODUCTION PROCESS THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-09-03 | — | — | US | disclosed |