⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20663200 | 0.76 | — | — | |
| Propyne SCHEMBL675906 | 0.71 | — | — | |
| SCHEMBL9793648 | 0.70 | — | — | |
| SCHEMBL8072745 | 0.67 | — | — | |
| SCHEMBL1862443 | 0.67 | — | — | |
| SCHEMBL27801214 | 0.67 | — | — | |
| SCHEMBL28695973 | 0.67 | CYP11B1 (0.31) | — | |
| SCHEMBL4605224 | 0.67 | — | — | |
| SCHEMBL29695880 | 0.67 | — | — | |
| SCHEMBL28546517 | 0.67 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116606310-B | Heterogeneous catalyst for catalyzing alkyne and B2Pin2Application in borohydride reaction | 昆明理工大学 | 2025-05-23 | — | — | CN | disclosed |
| CN-116606310-A | Heterogeneous catalyst for catalyzing alkyne and B 2 Pin 2 Application in borohydride reaction | 昆明理工大学 | 2023-08-18 | — | — | CN | disclosed |
| US-6762198-B2 | SUCH AS 2-((4'-METHOXY-(1,1'-BIPHENYL)-4-YL)-SULFONYL)-AMINO-3-(2-PHENOXYMETHYL -(1,3)DIOXAN-2-YL)PROPIONIC ACID | THE PROCTER & GAMBLE COMPANY | 2004-07-13 | — | — | US | disclosed |
| US-20030225074-A1 | Dihetero-substituted metalloprotease inhibitors | THE PROCTER & GAMBLE COMPANY | 2003-12-04 | — | — | US | disclosed |
| US-6566381-B1 | For therapy of arthritis, cancer, cardiovascular disorder, skin disorder, ocular disorder, inflammation and gum disease | THE PROCTER & GAMBLE COMPANY | 2003-05-20 | — | — | US | disclosed |
| CN-1362951-A | Dihetero-substituted metalloprotease inhibitors | PROCTER & GAMBLE (US) | 2002-08-07 | — | — | CN | disclosed |
| EP-1165530-A2 | DIHETERO-SUBSTITUTED METALLOPROTEASE INHIBITORS | THE PROCTER & GAMBLE COMPANY (US) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000051993-A2 | DIHETERO-SUBSTITUTED METALLOPROTEASE INHIBITORS | THE PROCTER & GAMBLE COMPANY (US) | 2000-09-08 | — | — | WO | disclosed |