Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.38 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29920570 | 1.00 | CA2 (0.42) | CA2SMN1; SMN2LTB4RLTB4R2CYP2D6 | |
| SCHEMBL15451666 | 0.84 | LTB4R (0.41) | LTB4RLTB4R2CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL29920646 | 0.81 | CA2 (0.43) | CA2LTB4RLTB4R2HCRTR2DRD2 | |
| SCHEMBL29920642 | 0.81 | CA2 (0.43) | CA2LTB4RLTB4R2HCRTR2DRD2 | |
| SCHEMBL29920587 | 0.77 | CA2 (0.32) | CA2LTB4RLTB4R2 | |
| SCHEMBL29920659 | 0.77 | CA2 (0.32) | CA2LTB4RLTB4R2 | |
| SCHEMBL29920510 | 0.77 | CA2 (0.32) | CA2LTB4RLTB4R2 | |
| SCHEMBL442639 | 0.73 | CA2 (0.63) | CA2SMN1; SMN2LTB4RLTB4R2SLC6A2 | |
| SCHEMBL22248036 | 0.72 | HTT (0.54) | SMN1; SMN2LTB4RLTB4R2HCRTR2ALDH1A1 | |
| SCHEMBL25244697 | 0.72 | SLC6A2 (0.40) | LTB4RLTB4R2CYP2D6SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022217248-A1 | SUBSTITUTED SULFONAMIDE-CHROMAN COMPOUNDS, AND PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF | SUNOVION PHARMACEUTICALS INC. (US) | 2022-10-13 | — | — | WO | disclosed |