⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28581085 | 0.79 | — | — | |
| SCHEMBL7896395 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL6265677 | 0.72 | — | — | |
| SCHEMBL8168353 | 0.72 | CYP1A2 (0.41) | — | |
| Trichloroacetic Acid SCHEMBL5874938 | 0.72 | ALDH1A1 (0.59) | — | |
| SCHEMBL9193098 | 0.72 | — | — | |
| SCHEMBL8370118 | 0.72 | — | — | |
| SCHEMBL22009126 | 0.72 | CYP1A2 (0.41) | — | |
| SCHEMBL22009188 | 0.72 | CYP1A2 (0.41) | — | |
| SCHEMBL15636111 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240391958-A1 | KEANUMYCINS AND USES THEREOF IN MEDICINE AND PLANT PROTECTION | LEIBNIZ-INSTITUT FÜR NATURSTOFF-FORSCHUNG UND INFEKTIONSBIOLOGIE E. V. HANS-KNÖLL-INSTITUT (HKI) (DE) | 2024-11-28 | — | — | US | disclosed |
| WO-2003025005-A2 | PURIFIED BACTERIAL POLYPEPTIDES INVOLVED IN PROTEIN PROCESSING | AFFINIUM PHARMACEUTICALS, INC. (CA) | 2003-03-27 | — | — | WO | disclosed |