⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27464393 | 0.83 | CYP2C19 (0.37) | — | |
| SCHEMBL25260436 | 0.80 | — | — | |
| SCHEMBL15268555 | 0.78 | — | — | |
| SCHEMBL1448365 | 0.77 | — | — | |
| SCHEMBL711319 | 0.75 | — | — | |
| SCHEMBL7049665 | 0.72 | — | — | |
| SCHEMBL4390932 | 0.72 | KDM4E (0.31) | — | |
| SCHEMBL5161314 | 0.72 | — | — | |
| SCHEMBL29185348 | 0.72 | — | — | |
| SCHEMBL9798413 | 0.70 | TSHR (0.36) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8673151-B2 | Method of modifying surface of material | SHISEIDO COMPANY, LTD. (JP) | 2014-03-18 | — | — | US | disclosed |
| US-20100285252-A1 | Method Of Modifying Surface Of Material | SHISEIDO COMPANY, LTD. (JP) | 2010-11-11 | — | — | US | disclosed |
| US-7560023-B2 | Method of modifying surface of material | SHISEIDO COMPANY, LTD. (JP) | 2009-07-14 | — | — | US | disclosed |
| US-20060060533-A1 | Method of modifying surface of material | SANYO FINE IRICA TECHNOLOGY CO., LTD. (JP) | 2006-03-23 | — | — | US | disclosed |
| EP-1577360-A1 | METHOD OF MODIFYING SURFACE OF MATERIAL | SHISEIDO COMPANY LIMITED (JP) | 2005-09-21 | — | — | EP | disclosed |