Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL27056099 | 1.00 | SMN1; SMN2 (0.33) | SMN1; SMN2PTGS2RAB9A | |
| SCHEMBL1554821 | 0.82 | HCAR2 (0.31) | — | |
| SCHEMBL13336077 | 0.79 | SMN1; SMN2 (0.35) | SMN1; SMN2PTGS2RAB9A | |
| SCHEMBL18952022 | 0.78 | LMNA (0.31) | SMN1; SMN2RAB9A | |
| SCHEMBL21064527 | 0.77 | NPC1 (0.41) | RAB9A | |
| SCHEMBL1586151 | 0.75 | ALDH1A1 (0.41) | — | |
| SCHEMBL13336082 | 0.71 | PTGS2 (0.32) | SMN1; SMN2PTGS2 | |
| SCHEMBL27056098 | 0.69 | NPC1 (0.30) | — | |
| SCHEMBL30960712 | 0.69 | NPC1 (0.30) | — | |
| SCHEMBL30166648 | 0.69 | ALDH1A1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-118027018-A | Tetrahydrocyclopentyl [ c ] pyrrole methyl ketone derivative, preparation method and application thereof | 江苏恩华药业股份有限公司 | 2024-05-14 | — | — | CN | disclosed |