⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17802144 | 0.55 | — | — | |
| SCHEMBL2761891 | 0.55 | PRKCG (0.43) | — | |
| SCHEMBL31064173 | 0.54 | ALDH1A1 (0.42) | — | |
| SCHEMBL16418923 | 0.52 | NOS3 (0.54) | — | |
| SCHEMBL6277647 | 0.52 | UHRF1 (0.37) | — | |
| SCHEMBL903631 | 0.52 | CHRNB2 (0.35) | — | |
| SCHEMBL30937637 | 0.52 | PTGS2 (0.37) | — | |
| SCHEMBL17802101 | 0.52 | METAP1 (0.49) | — | |
| SCHEMBL31064340 | 0.52 | PRKCG (0.38) | — | |
| SCHEMBL13259405 | 0.51 | ABL1 (0.58) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024148191-A1 | MODULATORS OF TNF-α ACTIVITY | FORWARD THERAPEUTICS, INC. (US) | 2024-07-11 | — | — | WO | disclosed |