Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | CES1 | P23141 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7137680 | 0.98 | ALDH1A1 (0.66) | ALDH1A1MAPK1SMN1; SMN2CYP3A4ATM | |
| SCHEMBL8501497 | 0.96 | ALDH1A1 (0.63) | ALDH1A1MAPK1SMN1; SMN2CYP3A4ATM | |
| SCHEMBL3291219 | 0.93 | ALDH1A1 (0.66) | ALDH1A1MAPK1SMN1; SMN2CYP3A4MEN1 | |
| SCHEMBL4732452 | 0.90 | ALDH1A1 (0.58) | ALDH1A1MAPK1SMN1; SMN2CYP3A4ATM | |
| SCHEMBL29955780 | 0.90 | ALDH1A1 (0.58) | ALDH1A1MAPK1SMN1; SMN2CYP3A4ATM | |
| SCHEMBL13307462 | 0.88 | ALDH1A1 (0.56) | ALDH1A1MAPK1SMN1; SMN2CYP3A4ATM | |
| SCHEMBL10050753 | 0.86 | TSHR (0.63) | ALDH1A1MAPK1SMN1; SMN2CYP3A4MEN1 | |
| SCHEMBL7112034 | 0.86 | CA5A (0.59) | ALDH1A1MAPK1SMN1; SMN2CYP3A4MEN1 | |
| SCHEMBL13307458 | 0.85 | ATM (0.56) | ALDH1A1MAPK1SMN1; SMN2CYP3A4ATM | |
| SCHEMBL4731202 | 0.85 | HTT (0.58) | ALDH1A1MAPK1SMN1; SMN2MEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0964849-A1 | SULFONYL UREA DERIVATIVES AND THEIR USE IN THE CONTROL OF INTERLEUKIN-1 ACTIVITY | PFIZER INC. (US) | 1999-12-22 | — | — | EP | disclosed |
| WO-1998032733-A1 | SULFONYL UREA DERIVATIVES AND THEIR USE IN THE CONTROL OF INTERLEUKIN-1 ACTIVITY | PFIZER INC. (US) | 1998-07-30 | — | — | WO | disclosed |