⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6915310 | 0.82 | TSHR (0.42) | — | |
| SCHEMBL4289794 | 0.75 | TSHR (0.31) | — | |
| SCHEMBL28621987 | 0.74 | — | — | |
| SCHEMBL6575653 | 0.71 | — | — | |
| SCHEMBL435798 | 0.71 | — | — | |
| SCHEMBL22393035 | 0.69 | TSHR (0.35) | — | |
| Lithium SCHEMBL30095513 | 0.68 | — | — | |
| SCHEMBL9192082 | 0.67 | — | — | |
| SCHEMBL360449 | 0.67 | — | — | |
| SCHEMBL10773302 | 0.65 | MEN1 (0.30) | — |
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-20040097366-A1 | Polyolefin-based composite resin, method for production thereof, catalyst for polymerization of vinly compound and method for polymerization of vinly compound using the same | IDEMITSU KOSAN CO. LTD. (JP) | 2004-05-20 | — | — | US | disclosed |
| EP-0499233-B1 | Organopentasiloxane and method for its preparation | DOW CORNING TORAY SILICONE (JP) | 1995-09-27 | — | — | EP | disclosed |
| US-5183912-A | ORGANOPENTASILOXANE AND METHOD FOR ITS PREPARATION | DOW CORNING TORAY SILICONE CO., LTD. (JP) | 1993-02-02 | — | — | US | disclosed |
| EP-0499233-A2 | Organopentasiloxane and method for its preparation | Dow Corning Toray Silicone Company, Limited (JP) | 1992-08-19 | — | — | EP | disclosed |