⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16110766 | 0.76 | SMPD1 (0.33) | — | |
| SCHEMBL5963622 | 0.75 | SMPD1 (0.39) | — | |
| SCHEMBL10447789 | 0.75 | SMPD1 (0.39) | — | |
| SCHEMBL466790 | 0.75 | CTSA (0.36) | — | |
| Phosphorylisopropane SCHEMBL82996 | 0.75 | — | — | |
| Phosphorylisopropane SCHEMBL11420590 | 0.73 | CTSA (0.48) | — | |
| Phosphorylisopropane SCHEMBL17670026 | 0.73 | CTSA (0.48) | — | |
| Phosphorylisopropane SCHEMBL11269158 | 0.73 | CTSA (0.48) | — | |
| Phosphorylisopropane SCHEMBL10821980 | 0.73 | — | — | |
| SCHEMBL8056927 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-118434398-A | Curable composition for dental use | 可乐丽则武齿科株式会社 | 2024-08-02 | — | — | CN | disclosed |
| US-6030960-A | INHIBITING THE PRODUCTION OF HEPATITIS VIRUS-INDUCED ANTIGENS IN A HUMAN SUBJECT BY ADMINISTERING A COMPOUND | WAKE FOREST UNIVERSITY (US) | 2000-02-29 | — | — | US | disclosed |
| US-5770584-A | ADMINISTERING AN ALKYL LIPID OR ALKYL LIPID DERIVATIVE VIRICIDES | WAKE FOREST UNIVERSITY (US) | 1998-06-23 | — | — | US | disclosed |
| WO-1993001196-A1 | KETOALKYLGLYCEROPHOSPHOLIPIDS HAVING ANTITUMOR AND ANTI-PLATELET AGGREGATION ACTIVITIES, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREFROM | LABORATORIOS MENARINI S.A. (ES) | 1993-01-21 | — | — | WO | disclosed |
| US-4119714-A | IMMUNE RESPONSE | MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E. V. (DE) | 1978-10-10 | — | — | US | disclosed |