⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL3848823 | 0.89 | — | — | |
| Methane SCHEMBL27955585 | 0.89 | — | — | |
| Methane SCHEMBL27629307 | 0.89 | — | — | |
| Methane SCHEMBL27670801 | 0.80 | — | — | |
| SCHEMBL28204377 | 0.80 | — | — | |
| Methane SCHEMBL28691563 | 0.80 | — | — | |
| Methane SCHEMBL28265266 | 0.80 | — | — | |
| Methane SCHEMBL3848706 | 0.80 | — | — | |
| SCHEMBL10942878 | 0.78 | — | — | |
| SCHEMBL28547820 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111778471-A | Wear-resistant antifriction iron-based amorphous composite coating and preparation method thereof | 扬州大学 | 2020-10-16 | — | — | CN | claimed |
| CN-105531391-A | Fiber-containing composite material | LIQUIDMETAL COATINGS LLC | 2016-04-27 | — | — | CN | claimed |
| CN-105531391-A | Fiber-containing composite material | LIQUIDMETAL COATINGS LLC | 2016-04-27 | — | — | CN | disclosed |