Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1666449 | 0.73 | — | — | |
| SCHEMBL3295484 | 0.73 | — | — | |
| SCHEMBL51838 | 0.73 | — | — | |
| SCHEMBL29883233 | 0.73 | — | — | |
| SCHEMBL4555579 | 0.72 | PARP1 (0.31) | PARP1PARP15PARP10 | |
| SCHEMBL4713780 | 0.71 | — | — | |
| SCHEMBL10775241 | 0.71 | THRA (0.61) | THRATHRB | |
| SCHEMBL17235754 | 0.71 | — | — | |
| SCHEMBL13797790 | 0.71 | — | — | |
| SCHEMBL4857880 | 0.71 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1101044-A | 2-(3-oxoalk(en)yl)-3-isothiazolones and derivatives as antimicrobial agents | ROHM & HAAS (US) | 1995-04-05 | — | — | CN | disclosed |
| EP-0630891-A1 | 3-Isothiazolones derivatives and their use as antimicrobial agents | ROHM AND HAAS COMPANY (US) | 1994-12-28 | — | — | EP | disclosed |
| US-5321141-A | Reacting an isothiazole with an a,b-unsaturated ketone or aldehyde | ROHM AND HAAS COMPANY (US) | 1994-06-14 | — | — | US | disclosed |
| US-5288693-A | Microbiocides | ROHM AND HAAS COMPANY (US) | 1994-02-22 | — | — | US | disclosed |