Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL16647876 | 1.00 | TRPA1 (0.60) | TRPA1CTSC | |
| Hydrochloric Acid SCHEMBL16635015 | 0.99 | TRPA1 (0.59) | TRPA1CTSC | |
| Hydrochloric Acid SCHEMBL17959547 | 0.99 | TRPA1 (0.59) | TRPA1CTSC | |
| Hydrochloric Acid SCHEMBL16635013 | 0.99 | TRPA1 (0.59) | TRPA1CTSC | |
| SCHEMBL20113195 | 0.91 | TRPA1 (0.62) | TRPA1 | |
| SCHEMBL16647885 | 0.91 | TRPA1 (0.62) | TRPA1 | |
| Hydrochloric Acid SCHEMBL17959521 | 0.90 | TRPA1 (0.61) | TRPA1 | |
| Hydrochloric Acid SCHEMBL16635235 | 0.90 | TRPA1 (0.61) | TRPA1 | |
| Hydrochloric Acid SCHEMBL16635237 | 0.90 | TRPA1 (0.61) | TRPA1 | |
| SCHEMBL16647889 | 0.84 | TRPA1 (0.60) | TRPA1CTSC |
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-3055302-A1 | SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS | F. Hoffmann-La Roche AG (CH) | 2016-08-17 | — | — | EP | disclosed |
| WO-2015052264-A1 | SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2015-04-16 | — | — | WO | disclosed |