⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28687169 | 0.77 | FDPS (0.32) | — | |
| SCHEMBL14353701 | 0.76 | ALDH1A1 (0.30) | — | |
| SCHEMBL21764582 | 0.74 | LMNA (0.31) | — | |
| SCHEMBL21764561 | 0.68 | TSHR (0.39) | — | |
| SCHEMBL15457454 | 0.67 | — | — | |
| SCHEMBL27934343 | 0.67 | — | — | |
| SCHEMBL4611197 | 0.65 | — | — | |
| SCHEMBL3473912 | 0.65 | ALDH1A1 (0.33) | — | |
| SCHEMBL21764583 | 0.65 | ALDH1A1 (0.35) | — | |
| SCHEMBL24329091 | 0.64 | LAP3 (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3984540-A2 | ANTIMICROBIAL COMPOUNDS AND METHODS OF USE | Aequor, Inc. (US) | 2022-04-20 | — | — | EP | disclosed |
| EP-3474860-B1 | ANTIMICROBIAL COMPOUNDS AND METHODS OF USE | AEQUOR INC (US) | 2021-12-15 | — | — | EP | disclosed |
| US-20200060280-A1 | Antimicrobial Compounds and Methods of Use | AEQUOR, INC. | 2020-02-27 | — | — | US | disclosed |