⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28370752 | 0.84 | — | — | |
| SCHEMBL8916162 | 0.79 | — | — | |
| SCHEMBL29063081 | 0.76 | — | — | |
| SCHEMBL4476456 | 0.76 | — | — | |
| SCHEMBL1237924 | 0.75 | — | — | |
| SCHEMBL841879 | 0.75 | — | — | |
| SCHEMBL1568375 | 0.75 | — | — | |
| SCHEMBL28643373 | 0.74 | — | — | |
| SCHEMBL28306025 | 0.74 | — | — | |
| SCHEMBL2476515 | 0.73 | — | — |
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-20100111885-A1 | Hair-Shape Controlling Composition | SHISEIDO COMPANY, LTD. (JP) | 2010-05-06 | — | — | US | disclosed |
| US-6197318-B1 | CONTAINING XYLOGLUCAN | SHISEIDO COMPANY, LTD. (JP) | 2001-03-06 | — | — | US | disclosed |
| EP-0965321-A1 | COMPOSITION FOR EXTERNAL USE | SHISEIDO COMPANY LIMITED (JP) | 1999-12-22 | — | — | EP | disclosed |
| US-5521238-A | WITH AN ALKOXY-GROUP CONTAINING ORGANOSILICON COMPOUND, SURFACTANT AND WATER; LACK OF OFFENSIVE ODOR; GOOD STORAGE STABILITY; IMPROVES FEEL OF TREATED FIBERS | DOW CORNING TORAY SILICONE CO., LTD. (JP) | 1996-05-28 | — | — | US | disclosed |