⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12002806 | 0.89 | — | — | |
| SCHEMBL130323 | 0.88 | — | — | |
| SCHEMBL20954169 | 0.85 | — | — | |
| SCHEMBL329792 | 0.84 | — | — | |
| SCHEMBL16163485 | 0.84 | LMNA (0.33) | — | |
| SCHEMBL15854985 | 0.84 | — | — | |
| SCHEMBL329700 | 0.83 | SLC2A1 (0.37) | — | |
| SCHEMBL135493 | 0.80 | — | — | |
| SCHEMBL16813802 | 0.80 | SLC2A1 (0.35) | — | |
| SCHEMBL4059534 | 0.79 | — | — |
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-9527932-B2 | Method for producing denatured conjugated diene polymer | JSR CORPORATION (JP) | 2016-12-27 | — | — | US | disclosed |
| US-20140309363-A1 | METHOD FOR PRODUCING DENATURED CONJUGATED DIENE POLYMER | JSR CORPORATION (JP) | 2014-10-16 | — | — | US | disclosed |