⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26512413 | 0.91 | — | — | |
| SCHEMBL26512407 | 0.84 | BRAF (0.31) | — | |
| SCHEMBL26512454 | 0.82 | — | — | |
| SCHEMBL26512418 | 0.82 | — | — | |
| SCHEMBL26512457 | 0.82 | KMT2A (0.36) | — | |
| SCHEMBL26118032 | 0.77 | CDK2 (0.33) | — | |
| SCHEMBL26512299 | 0.77 | DEPTOR (0.43) | — | |
| SCHEMBL26512455 | 0.77 | — | — | |
| SCHEMBL26512409 | 0.77 | OPRM1 (0.31) | — | |
| SCHEMBL26512490 | 0.75 | GAA (0.33) | — |
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-20230321043-A1 | COMPOUNDS HAVING PSEUDOMONAS ANTI-BIOFILM PROPERTIES | UNIV COPENHAGEN (DK) | 2023-10-12 | — | — | US | disclosed |
| US-20230321043-A1 | COMPOUNDS HAVING PSEUDOMONAS ANTI-BIOFILM PROPERTIES | UNIV COPENHAGEN (DK) | 2023-10-12 | — | — | US | disclosed |