⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL107198 | 0.82 | MAPT (0.61) | — | |
| SCHEMBL138489 | 0.82 | MAPT (0.61) | — | |
| SCHEMBL31175769 | 0.79 | MAPT (0.58) | — | |
| SCHEMBL9966009 | 0.79 | MAPT (0.65) | — | |
| SCHEMBL135604 | 0.79 | MAPT (0.65) | — | |
| SCHEMBL11211999 | 0.78 | MAOB (0.42) | — | |
| SCHEMBL11212004 | 0.78 | MAOB (0.42) | — | |
| SCHEMBL11209918 | 0.78 | MAOB (0.42) | — | |
| SCHEMBL1509973 | 0.78 | CYP11B2 (0.62) | — | |
| SCHEMBL10032044 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116218505-B | Oil well fracturing cementing agent, oil well fracturing support composition, and preparation and application thereof | 中国石油化工股份有限公司 | 2024-03-22 | — | — | CN | disclosed |
| CN-116218505-A | Oil well fracturing cementing agent, oil well fracturing support composition, and preparation and application thereof | 中国石油化工股份有限公司 | 2023-06-06 | — | — | CN | disclosed |