Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18799682 | 0.88 | RORC (0.40) | — | |
| SCHEMBL8341494 | 0.85 | TAAR1 (0.50) | TAAR1KMT2AATMMEN1GAA | |
| SCHEMBL16886243 | 0.84 | SMN1; SMN2 (0.44) | TAAR1KMT2AATMMEN1GAA | |
| SCHEMBL20002774 | 0.82 | ACHE (0.36) | KMT2A | |
| SCHEMBL16886260 | 0.81 | RORC (0.39) | — | |
| SCHEMBL20002194 | 0.79 | KDM1A (0.39) | KMT2AMEN1TDP1SMN1; SMN2L3MBTL1 | |
| SCHEMBL20002758 | 0.78 | RORC (0.36) | — | |
| SCHEMBL18214991 | 0.78 | RORC (0.40) | TAAR1GAASMN1; SMN2 | |
| SCHEMBL20001981 | 0.77 | RORC (0.37) | AR | |
| SCHEMBL8489211 | 0.75 | TAAR1 (0.55) | TAAR1KMT2AATMMEN1GAA |
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 |