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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10945726 | 0.90 | SMN1; SMN2 (0.43) | L3MBTL1GSTO1SMN1; SMN2HPGDMAP2K7 | |
| SCHEMBL10944680 | 0.84 | SMN1; SMN2 (0.39) | SMN1; SMN2KMT2APOLBHTTGAA | |
| SCHEMBL10668835 | 0.78 | SMN1; SMN2 (0.48) | L3MBTL1GSTO1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL10797916 | 0.76 | L3MBTL1 (0.46) | L3MBTL1GSTO1SMN1; SMN2HPGDKMT2A | |
| SCHEMBL10944821 | 0.76 | L3MBTL1 (0.44) | L3MBTL1GSTO1KDM4ESMN1; SMN2HPGD | |
| Hydrochloric Acid SCHEMBL10949886 | 0.73 | SMN1; SMN2 (0.43) | KDM4ESMN1; SMN2KMT2AMAP2K7 | |
| SCHEMBL10348347 | 0.71 | PARP1 (0.49) | L3MBTL1GSTO1SMN1; SMN2HPGDKMT2A | |
| SCHEMBL11036856 | 0.71 | L3MBTL1 (0.42) | L3MBTL1GSTO1SMN1; SMN2HPGDMAP2K7 | |
| SCHEMBL7217431 | 0.67 | SMN1; SMN2 (0.44) | KDM4ESMN1; SMN2HPGDKMT2APOLB | |
| SCHEMBL4011328 | 0.66 | POLB (0.56) | KDM4ESMN1; SMN2HPGDKMT2APOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-4493755-A | Electrolytic preparation of orthoalkyl-2-halo-N-acylanilides | MONSANTO COMPANY (US) | 1985-01-15 | — | — | US | disclosed |