Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002867 | 1.00 | ALDH1A1 (0.39) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL28261770 | 0.80 | ALDH1A1 (0.42) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL15052626 | 0.78 | SMN1; SMN2 (0.44) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL22365839 | 0.78 | SMN1; SMN2 (0.44) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL283932 | 0.78 | SMN1; SMN2 (0.44) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL6879374 | 0.76 | ALDH1A1 (0.39) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL16892251 | 0.76 | ALDH1A1 (0.39) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL27936064 | 0.76 | ALDH1A1 (0.39) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL16892259 | 0.76 | ALDH1A1 (0.39) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL7559472 | 0.76 | KDM4E (0.39) | ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3092229-B1 | PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2018-03-28 | — | — | EP | disclosed |