⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28999165 | 0.92 | — | — | |
| SCHEMBL28999230 | 0.89 | MAPT (0.32) | — | |
| SCHEMBL28999199 | 0.89 | MAPT (0.32) | — | |
| SCHEMBL1469750 | 0.81 | — | — | |
| SCHEMBL28999374 | 0.80 | — | — | |
| SCHEMBL28999238 | 0.80 | ALDH1A1 (0.39) | — | |
| SCHEMBL25597385 | 0.80 | — | — | |
| SCHEMBL7772676 | 0.79 | — | — | |
| SCHEMBL10231127 | 0.79 | — | — | |
| SCHEMBL28999204 | 0.78 | MAPT (0.41) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119219824-A | Crosslinked polymer and preparation method and application thereof | 中国石油化工股份有限公司 | 2024-12-31 | — | — | CN | disclosed |
| CN-119219840-A | Crosslinked polymer and preparation method and application thereof | 中国石油化工股份有限公司 | 2024-12-31 | — | — | CN | disclosed |
| CN-116063345-B | Phosphonic acid group monomer and preparation method thereof | 中国石油化工股份有限公司 | 2024-08-06 | — | — | CN | disclosed |
| CN-116063626-B | Anti-calcium shrinkage and expansion agent and preparation method and application thereof | 中国石油化工股份有限公司 | 2024-05-07 | — | — | CN | disclosed |
| CN-116064016-B | Scale inhibition anti-swelling shrinkage swelling agent and preparation method and application thereof | 中国石油化工股份有限公司 | 2024-04-05 | — | — | CN | disclosed |
| CN-116064016-A | Scale inhibition anti-swelling shrinkage swelling agent and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-05-05 | — | — | CN | disclosed |
| CN-116063345-A | Phosphonic acid group monomer and preparation method thereof | 中国石油化工股份有限公司 | 2023-05-05 | — | — | CN | disclosed |
| CN-116063626-A | Anti-calcium shrinkage and expansion agent and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-05-05 | — | — | CN | disclosed |
| US-6492364-B1 | Triazolo and derivatives as chemokine inhibitors | TORAY INDUSTRIES, INC. (JP) | 2002-12-10 | — | — | US | disclosed |
| EP-1067130-A1 | TRIAZOLO DERIVATIVES AND CHEMOKINE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | TORAY INDUSTRIES, INC. (JP) | 2001-01-10 | — | — | EP | disclosed |