⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8668734 | 0.84 | — | — | |
| SCHEMBL1156661 | 0.82 | MMP2 (0.36) | — | |
| SCHEMBL67111 | 0.77 | — | — | |
| SCHEMBL8746938 | 0.74 | KDM4A (0.47) | — | |
| SCHEMBL7707701 | 0.74 | KDM4A (0.47) | — | |
| SCHEMBL5136363 | 0.74 | — | — | |
| SCHEMBL27709235 | 0.74 | CHRM2 (0.37) | — | |
| SCHEMBL5417885 | 0.72 | — | — | |
| SCHEMBL14944835 | 0.72 | ALDH1A1 (0.47) | — | |
| SCHEMBL12179743 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0003618-B1 | ANTIBACTERIAL COMPOSITION AND USE THEREOF | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1981-01-28 | — | — | EP | claimed |
| WO-2021074452-A1 | COMBINATION PREPARATIONS OF 3-N-FORMYLHYDROXYLAMINOPROPYL PHOSPHONIC ACID DERIVATIVES OR 3-N-ACETYLHYDROXYLAMINOPROPYL PHOSPHONIC ACID DERIVATIVES WITH CLINDAMYCIN AND ARTESUNATE | DMG DEUTSCHE MALARIA GMBH (DE) | 2021-04-22 | — | — | WO | disclosed |
| EP-1071959-A2 | METHOD FOR IDENTIFYING CHEMICAL ACTIVE AGENTS AND ACTIVE AGENTS FOR INHIBITING THE 1-DESOXY-D-XYLULOSE-5-PHOSPHATE BIOSYNTHETIC PATHWAY | Hassan, Jomaa (DE) | 2001-01-31 | — | — | EP | disclosed |
| WO-1999052938-A2 | IDENTIFICATION OF CHEMICAL ACTIVE AGENTS FOR INHIBITING THE 1-DESOXY-D-XYLULOSE-5-PHOSPHATE BIOSYNTHETIC PATHWAY IN PARASITES | JOMAA HASSAN (DE) | 1999-10-21 | — | — | WO | disclosed |
| US-5783689-A | Antibacterial and antifungal nucleosides | UNIVERSITY OF NOTRE DAME (US) | 1998-07-21 | — | — | US | disclosed |