Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9380229 | 1.00 | ALDH1A1 (0.45) | ALDH1A1NPC1RAB9APDPK1SMN1; SMN2 | |
| SCHEMBL9261965 | 0.88 | NPC1 (0.47) | ALDH1A1NPC1RAB9APDPK1SMN1; SMN2 | |
| SCHEMBL9261958 | 0.88 | NPC1 (0.47) | ALDH1A1NPC1RAB9APDPK1SMN1; SMN2 | |
| SCHEMBL9264279 | 0.85 | CYP1A2 (0.46) | ALDH1A1NPC1RAB9ASMN1; SMN2DDB1 | |
| SCHEMBL9264273 | 0.85 | CYP1A2 (0.46) | ALDH1A1NPC1RAB9ASMN1; SMN2DDB1 | |
| SCHEMBL9261268 | 0.85 | NPC1 (0.45) | ALDH1A1NPC1RAB9ASMN1; SMN2DDB1 | |
| SCHEMBL9261261 | 0.85 | NPC1 (0.45) | ALDH1A1NPC1RAB9ASMN1; SMN2DDB1 | |
| SCHEMBL9268942 | 0.83 | NPC1 (0.35) | ALDH1A1NPC1RAB9ASMN1; SMN2CTSK | |
| SCHEMBL9268939 | 0.83 | NPC1 (0.35) | ALDH1A1NPC1RAB9ASMN1; SMN2CTSK | |
| SCHEMBL9268156 | 0.83 | FFAR1 (0.46) | ALDH1A1NPC1RAB9ASMN1; SMN2CTSK |
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-0613463-A1 | DERIVATIVES OF CYCLIC PHENOLIC THIOETHERS AS INHIBITORS OR STIMULATORS OF SUPEROXIDE GENERATION | G.D. SEARLE & CO. (US) | 1994-09-07 | — | — | EP | disclosed |
| WO-1993010087-A1 | DERIVATIVES OF CYCLIC PHENOLIC THIOETHERS AS INHIBITORS OR STIMULATORS OF SUPEROXIDE GENERATION | G.D. SEARLE & CO. (US) | 1993-05-27 | — | — | WO | disclosed |