⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16285034 | 0.93 | MAOB (0.30) | — | |
| SCHEMBL16285041 | 0.81 | — | — | |
| SCHEMBL4669478 | 0.75 | — | — | |
| SCHEMBL16285037 | 0.73 | MAOB (0.32) | — | |
| SCHEMBL3309477 | 0.73 | MAOB (0.32) | — | |
| SCHEMBL27431199 | 0.70 | — | — | |
| SCHEMBL8818511 | 0.69 | CES2 (0.32) | — | |
| SCHEMBL8984071 | 0.67 | ALOX15 (0.30) | — | |
| SCHEMBL2928523 | 0.67 | — | — | |
| SCHEMBL16133346 | 0.67 | MEN1 (0.32) | — |
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-20150191629-A1 | SURFACE MODIFIER AND ARTICLE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2015-07-09 | — | — | US | disclosed |
| US-20140363682-A1 | SURFACE MODIFIER AND ARTICLE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2014-12-11 | — | — | US | disclosed |