⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14735657 | 0.94 | — | — | |
| SCHEMBL14735782 | 0.92 | — | — | |
| SCHEMBL14735793 | 0.90 | CES2 (0.36) | — | |
| SCHEMBL3833191 | 0.90 | ACHE (0.33) | — | |
| SCHEMBL14735672 | 0.89 | ACHE (0.33) | — | |
| Hydrochloric Acid SCHEMBL811766 | 0.89 | CES2 (0.36) | — | |
| SCHEMBL4429943 | 0.87 | CES2 (0.34) | — | |
| Hydrochloric Acid SCHEMBL811732 | 0.86 | ALDH1A1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL812867 | 0.85 | — | — | |
| SCHEMBL14735582 | 0.84 | CES2 (0.34) | — |
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-2275457-B1 | Propylene-based polymer composition, and molded products, sheets, films, laminates and non-woven fabrics obtained therefrom | MITSUI CHEMICALS INC (JP) | 2016-11-23 | — | — | EP | disclosed |
| EP-2275451-B1 | Method for producing propylene-based copolymer | MITSUI CHEMICALS INC (JP) | 2016-10-19 | — | — | EP | disclosed |
| EP-2080784-B1 | PROPYLENE RESIN COMPOSITION, METHOD FOR PRODUCING PROPYLENE RESIN COMPOSITION, PROPYLENE POLYMER COMPOSITION, MOLDED BODY MADE OF THE PROPYLENE RESIN COMPOSITION, AND ELECTRIC WIRE | MITSUI CHEMICALS INC (JP) | 2013-03-06 | — | — | EP | disclosed |