⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8506166 | 0.89 | — | — | |
| SCHEMBL720922 | 0.80 | — | — | |
| SCHEMBL21112999 | 0.80 | — | — | |
| SCHEMBL27548494 | 0.78 | — | — | |
| SCHEMBL11323442 | 0.78 | — | — | |
| SCHEMBL15399 | 0.78 | — | — | |
| SCHEMBL2286219 | 0.78 | — | — | |
| SCHEMBL29168486 | 0.73 | — | — | |
| Phosphine SCHEMBL28764764 | 0.73 | — | — | |
| SCHEMBL28209421 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8173010-B2 | Method of dry reforming a reactant gas with intermetallic catalyst | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2012-05-08 | — | — | US | disclosed |
| US-20060280998-A1 | Electrode and catalytic materials | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2006-12-14 | — | — | US | disclosed |
| WO-2006125177-A2 | ELECTRODE AND CATALYTIC MATERIALS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2006-11-23 | — | — | WO | disclosed |