⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21241261 | 0.69 | — | — | |
| SCHEMBL19706178 | 0.60 | — | — | |
| SCHEMBL20402482 | 0.53 | ALDH1A1 (0.38) | — | |
| SCHEMBL3369157 | 0.53 | — | — | |
| SCHEMBL1246293 | 0.46 | MEN1 (0.30) | — | |
| SCHEMBL5831499 | 0.46 | ALDH1A1 (0.36) | — | |
| SCHEMBL2417534 | 0.43 | — | — | |
| SCHEMBL3960199 | 0.42 | — | — | |
| SCHEMBL2181354 | 0.42 | — | — | |
| SCHEMBL8863655 | 0.42 | — | — |
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-9837624-B2 | Tailoring the optical gap and absorption strength of silicon quantum dots by surface modification with conjugated organic moieties | COLORADO SCHOOL OF MINES (US) | 2017-12-05 | — | — | US | disclosed |
| US-20150311289-A1 | Tailoring the Optical Gap and Absorption Strength of Silicon Quantum Dots by Surface Modification with Conjugated Organic Moieties | NATIONAL SCIENCE FOUNDATION | 2015-10-29 | — | — | US | disclosed |