⚠ 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL4304630 | 0.97 | CXCR4 (0.35) | — | |
| SCHEMBL3474158 | 0.95 | CXCR4 (0.47) | — | |
| SCHEMBL642696 | 0.87 | — | — | |
| Pyrrolidine SCHEMBL2381731 | 0.85 | ALDH1A1 (0.47) | — | |
| Bromide SCHEMBL5323671 | 0.84 | — | — | |
| SCHEMBL8200673 | 0.84 | HIF1A (0.43) | — | |
| SCHEMBL5979256 | 0.84 | HIF1A (0.43) | — | |
| SCHEMBL2225649 | 0.84 | HIF1A (0.43) | — | |
| Water SCHEMBL6572613 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL1983463 | 0.84 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230241025-A1 | ANTIVIRAL USE OF FABP4 MODULATING COMPOUNDS | CRESCENTA BIOSCIENCES (US) | 2023-08-03 | — | — | US | disclosed |
| WO-2023137227-A1 | MULTI-VESICULAR LIPID NANOPARTICLE TOLEROGENIC VACCINES FOR INDUCTION OF SYSTEMIC IMMUNE TOLERANCE IN VIVO | KARMA BIOTECHNOLOGIES (US) | 2023-07-20 | — | — | WO | disclosed |
| US-7186277-B2 | Composition for dyeing keratin fibres, comprising a cationic para-phenylenediamine derivative substituted with a diazacyclohexane or diazacycloheptane ring | L'OREAL SA (FR) | 2007-03-06 | — | — | US | disclosed |
| EP-1521758-A1 | LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION | Exxonmobil Chemical Patents Inc. (US) | 2005-04-13 | — | — | EP | disclosed |
| WO-2004007509-A1 | LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2004-01-22 | — | — | WO | disclosed |