Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2927951 | 0.79 | CYP2C9 (0.50) | CYP2C9CYP1A2CYP2C19ALDH1A1KCNN4 | |
| SCHEMBL608329 | 0.73 | ALDH1A1 (0.53) | CYP2C9CYP1A2CYP2C19ALDH1A1TSHR | |
| SCHEMBL7623485 | 0.73 | CYP1A2 (0.46) | CYP2C9CYP1A2CYP2C19ALDH1A1TSHR | |
| SCHEMBL4278139 | 0.73 | CYP1A2 (0.46) | CYP2C9CYP1A2CYP2C19ALDH1A1TSHR | |
| SCHEMBL9056652 | 0.72 | CYP2C9 (0.54) | CYP2C9CYP1A2CYP2C19KCNN4HTT | |
| SCHEMBL28725257 | 0.72 | CYP1A2 (0.41) | CYP2C9CYP1A2CYP2C19ALDH1A1TSHR | |
| SCHEMBL1431990 | 0.72 | CYP2C9 (0.43) | CYP2C9CYP1A2CYP2C19ALDH1A1TSHR | |
| Benzylic Acid SCHEMBL7066 | 0.72 | CYP2C9 (0.74) | CYP2C9CYP1A2CYP2C19ALDH1A1TSHR | |
| SCHEMBL13894152 | 0.72 | CYP2C9 (0.43) | CYP2C9CYP1A2CYP2C19ALDH1A1TSHR | |
| Benzylic Acid SCHEMBL4823051 | 0.72 | CYP2C9 (0.65) | CYP2C9CYP1A2CYP2C19ALDH1A1KCNN4 |
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-20230387462-A1 | CYCLIC SULFONATE ADDITIVE FOR ELECTROLYTE OF LITHIUM-ION BATTERY (LIB) AND PREPARATION METHOD AND USE THEREOF | VALIANT CO., LTD. (CN) | 2023-11-30 | — | — | US | disclosed |
| US-20230387462-A1 | CYCLIC SULFONATE ADDITIVE FOR ELECTROLYTE OF LITHIUM-ION BATTERY (LIB) AND PREPARATION METHOD AND USE THEREOF | VALIANT CO., LTD. (CN) | 2023-11-30 | — | — | US | disclosed |