Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4568926 | 0.85 | KMT2A (0.55) | SMN1; SMN2KMT2AALDH1A1CYP2D6 | |
| SCHEMBL19485436 | 0.84 | SMN1; SMN2 (0.53) | SMN1; SMN2KMT2AMAPTMEN1NPC1 | |
| SCHEMBL2205020 | 0.84 | PDK2 (0.49) | SMN1; SMN2NPC1ALDH1A1MAPK1LMNA | |
| SCHEMBL29818912 | 0.84 | PDK2 (0.49) | SMN1; SMN2NPC1ALDH1A1MAPK1LMNA | |
| SCHEMBL6850974 | 0.83 | SMN1; SMN2 (0.65) | SMN1; SMN2KMT2AMAPTMEN1NPC1 | |
| SCHEMBL12217570 | 0.83 | SMN1; SMN2 (0.59) | SMN1; SMN2KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL13523837 | 0.83 | SMN1; SMN2 (0.65) | SMN1; SMN2KMT2AMAPTMEN1NPC1 | |
| SCHEMBL826321 | 0.83 | SMN1; SMN2 (0.65) | SMN1; SMN2KMT2AMAPTMEN1NPC1 | |
| SCHEMBL10054169 | 0.82 | L3MBTL1 (0.62) | SMN1; SMN2KMT2AMAPTMEN1NPC1 | |
| SCHEMBL11550936 | 0.81 | SMN1; SMN2 (0.63) | SMN1; SMN2KMT2AMAPTMEN1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9795687-B2 | Modularly assembled small molecules for the treatment of myotonic dystrophy type 1 | THE SCRIPPS RESEARCH INSTITUTE (US) | 2017-10-24 | — | — | US | disclosed |
| US-9795687-B2 | Modularly assembled small molecules for the treatment of myotonic dystrophy type 1 | THE SCRIPPS RESEARCH INSTITUTE (US) | 2017-10-24 | — | — | US | disclosed |