⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8597213 | 0.87 | GABRA1 (0.30) | — | |
| SCHEMBL5951493 | 0.82 | — | — | |
| SCHEMBL8469769 | 0.80 | PTGER4 (0.31) | — | |
| SCHEMBL1239968 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL7197451 | 0.79 | CYSLTR2 (0.30) | — | |
| SCHEMBL8150768 | 0.79 | CSNK2A2 (0.32) | — | |
| SCHEMBL5511716 | 0.76 | — | — | |
| SCHEMBL1240057 | 0.76 | TYR (0.34) | — | |
| SCHEMBL6463453 | 0.76 | — | — | |
| SCHEMBL15329297 | 0.75 | — | — |
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-6930152-B2 | Propylene polymer compositions | MITSUI CHEMICALS, INC. (JP) | 2005-08-16 | — | — | US | disclosed |
| US-20040230004-A1 | Propylene polymer compositions | MITSUI CHEMICALS, INC. | 2004-11-18 | — | — | US | disclosed |